NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
589766 2mxl 25416 cing 1-original 4 AMBER distance NOE simple


#
#   17   RC   H1'  17   RC    H6   3.16   5.04
 &rst
  ixpk= 0, nxpk= 0, iat= 523, 526, r1= 2.66, r2= 3.16, r3= 5.04, r4= 5.54, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#   17   RC   H2'  17   RC    H6   2.92   4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 526, r1= 2.42, r2= 2.92, r3= 4.65, r4= 5.15,  &end
#
#   17   RC   H2'  18   RA   H1'   3.71   5.92
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 554, r1= 3.21, r2= 3.71, r3= 5.92, r4= 6.42,  &end
#
#   17   RC   H2'  18   RA    H8   1.95   3.11
 &rst
  ixpk= 0, nxpk= 0, iat= 539, 557, r1= 1.45, r2= 1.95, r3= 3.11, r4= 3.61,  &end
#
#   17   RC   H3'  17   RC   H1'   2.91   4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 537, 523, r1= 2.41, r2= 2.91, r3= 4.65, r4= 5.15,  &end
#
#   17   RC   H3'  18   RA    H8   2.46   3.92
 &rst
  ixpk= 0, nxpk= 0, iat= 537, 557, r1= 1.96, r2= 2.46, r3= 3.92, r4= 4.42,  &end
#
#   18   RA   H1'  18   RA    H8   3.37   5.38
 &rst
  ixpk= 0, nxpk= 0, iat= 554, 557, r1= 2.87, r2= 3.37, r3= 5.38, r4= 5.88,  &end
#
#   18   RA   H2'  18   RA    H8   2.73   4.36
 &rst
  ixpk= 0, nxpk= 0, iat= 572, 557, r1= 2.23, r2= 2.73, r3= 4.36, r4= 4.86,  &end
#
#   18   RA   H3'  18   RA   H1'   3.52   5.62
 &rst
  ixpk= 0, nxpk= 0, iat= 570, 554, r1= 3.02, r2= 3.52, r3= 5.62, r4= 6.12,  &end
#
#   18   RA   H3'  18   RA    H8   2.09   3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 570, 557, r1= 1.59, r2= 2.09, r3= 3.33, r4= 3.83,  &end
#
#   19   RG   H1'  18   RA    H2   3.97   6.34
 &rst
  ixpk= 0, nxpk= 0, iat= 587, 566, r1= 3.47, r2= 3.97, r3= 6.34, r4= 6.84,  &end
#
#   19   RG   H2'  19   RG   H1'   2.23   3.55
 &rst
  ixpk= 0, nxpk= 0, iat= 606, 587, r1= 1.73, r2= 2.23, r3= 3.55, r4= 4.05,  &end
#
#   19   RG   H3'  19   RG    H8   2.15   3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 604, 590, r1= 1.65, r2= 2.15, r3= 3.43, r4= 3.93,  &end
#
#   19   RG   H4'  19   RG   H1'   2.49   3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 584, 587, r1= 1.99, r2= 2.49, r3= 3.97, r4= 4.47,  &end
#
#   20   RA   H1'  20   RA    H8   3.04   4.85
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 624, r1= 2.54, r2= 3.04, r3= 4.85, r4= 5.35,  &end
#
#   20   RA   H2'  20   RA    H8   2.99   4.77
 &rst
  ixpk= 0, nxpk= 0, iat= 639, 624, r1= 2.49, r2= 2.99, r3= 4.77, r4= 5.27,  &end
#
#   20   RA   H2'  21   RA   H1'   2.73   4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 639, 654, r1= 2.23, r2= 2.73, r3= 4.35, r4= 4.85,  &end
#
#   20   RA   H2'  21   RA    H8   2.19   3.49
 &rst
  ixpk= 0, nxpk= 0, iat= 639, 657, r1= 1.69, r2= 2.19, r3= 3.49, r4= 3.99,  &end
#
#   20   RA   H3'  20   RA    H8   2.59   4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 637, 624, r1= 2.09, r2= 2.59, r3= 4.13, r4= 4.63,  &end
#
#   20   RA   H3'  21   RA    H8   2.05   3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 637, 657, r1= 1.55, r2= 2.05, r3= 3.26, r4= 3.76,  &end
#
#   21   RA   H1'  20   RA    H2   2.57   4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 633, r1= 2.07, r2= 2.57, r3= 4.10, r4= 4.60,  &end
#
#   21   RA   H1'  21   RA    H8   3.53   5.63
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 657, r1= 3.03, r2= 3.53, r3= 5.63, r4= 6.13,  &end
#
#   21   RA   H2'  22   RA   H1'   3.96   6.31
 &rst
  ixpk= 0, nxpk= 0, iat= 672, 687, r1= 3.46, r2= 3.96, r3= 6.31, r4= 6.81,  &end
#
#   21   RA   H3'  21   RA    H8   2.29   3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 670, 657, r1= 1.79, r2= 2.29, r3= 3.65, r4= 4.15,  &end
#
#   22   RA   H1'  21   RA    H2   3.18   5.07
 &rst
  ixpk= 0, nxpk= 0, iat= 687, 666, r1= 2.68, r2= 3.18, r3= 5.07, r4= 5.57,  &end
#
#   22   RA   H4'  22   RA   H1'   2.94   4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 687, r1= 2.44, r2= 2.94, r3= 4.69, r4= 5.19,  &end
#
#   23   RC   H2'  23   RC    H6   2.84   4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 736, 723, r1= 2.34, r2= 2.84, r3= 4.54, r4= 5.04,  &end
#
#   25   RG   H3'  25   RG    H8   2.45   3.91
 &rst
  ixpk= 0, nxpk= 0, iat= 802, 788, r1= 1.95, r2= 2.45, r3= 3.91, r4= 4.41,  &end
#
#   17   RC   H3'  17   RC    H6   2.05   3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 537, 526, r1= 1.55, r2= 2.05, r3= 3.28, r4= 3.78, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#   18   RA   H2'  18   RA   H1'   2.05   3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 572, 554, r1= 1.55, r2= 2.05, r3= 3.28, r4= 3.78,  &end
#
#   18   RA   H2'  19   RG   H1'   2.91   4.65
 &rst
  ixpk= 0, nxpk= 0, iat= 572, 587, r1= 2.41, r2= 2.91, r3= 4.65, r4= 5.15,  &end
#
#   18   RA   H2'  19   RG    H8   2.39   3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 572, 590, r1= 1.89, r2= 2.39, r3= 3.81, r4= 4.31,  &end
#
#   19   RG   H2'  21   RA    H8   3.08   4.91
 &rst
  ixpk= 0, nxpk= 0, iat= 606, 657, r1= 2.58, r2= 3.08, r3= 4.91, r4= 5.41,  &end
#
#   19   RG   H3'  19   RG   H1'   3.23   5.15
 &rst
  ixpk= 0, nxpk= 0, iat= 604, 587, r1= 2.73, r2= 3.23, r3= 5.15, r4= 5.65,  &end
#
#   20   RA   H4'  20   RA   H1'   2.74   4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 618, 621, r1= 2.24, r2= 2.74, r3= 4.37, r4= 4.87,  &end
#
#   21   RA   H2'  21   RA   H1'   2.15   3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 672, 654, r1= 1.65, r2= 2.15, r3= 3.43, r4= 3.93,  &end
#
#   21   RA   H3'  21   RA   H1'   2.89   4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 670, 654, r1= 2.39, r2= 2.89, r3= 4.61, r4= 5.11,  &end
#
#   21   RA   H4'  21   RA   H1'   2.86   4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 654, r1= 2.36, r2= 2.86, r3= 4.56, r4= 5.06,  &end
#
#   22   RA   H2'  22   RA   H1'   2.27   3.62
 &rst
  ixpk= 0, nxpk= 0, iat= 705, 687, r1= 1.77, r2= 2.27, r3= 3.62, r4= 4.12,  &end
#
#   22   RA   H2'  23   RC    H6   2.21   3.53
 &rst
  ixpk= 0, nxpk= 0, iat= 705, 723, r1= 1.71, r2= 2.21, r3= 3.53, r4= 4.03,  &end
#
#   22   RA   H3'  23   RC    H6   2.08   3.31
 &rst
  ixpk= 0, nxpk= 0, iat= 703, 723, r1= 1.58, r2= 2.08, r3= 3.31, r4= 3.81,  &end
#
#   23   RC   H2'  24   RG   H1'   2.47   3.95
 &rst
  ixpk= 0, nxpk= 0, iat= 736, 751, r1= 1.97, r2= 2.47, r3= 3.95, r4= 4.45,  &end
#
#   17   RC   H41  24   RG    H1   1.40   3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 531, 760, r1= 0.90, r2= 1.40, r3= 3.26, r4= 3.76, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#   18   RA   H1'  24   RG    N2   1.57   4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 554, 762, r1= 1.07, r2= 1.57, r3= 4.67, r4= 5.17,  &end
#
#   22   RA    H8  19   RG   H21   1.73   4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 690, 599, r1= 1.23, r2= 1.73, r3= 4.03, r4= 4.53, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#   23   RC    N4  18   RA    H2   1.62   4.78
 &rst
  ixpk= 0, nxpk= 0, iat= 727, 566, r1= 1.12, r2= 1.62, r3= 4.78, r4= 5.28,  &end
#
#   25   RG   H1'  24   RG    N2   1.66   4.88
 &rst
  ixpk= 0, nxpk= 0, iat= 785, 762, r1= 1.16, r2= 1.66, r3= 4.88, r4= 5.38,  &end
#
#    8   RC   H2'   8   RC   H1'   2.05   3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 251, 235, r1= 1.55, r2= 2.05, r3= 3.28, r4= 3.78, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#    8   RC   H3'   8   RC    H6   1.91   3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 249, 238, r1= 1.41, r2= 1.91, r3= 3.05, r4= 3.55,  &end
#
#    8   RC   H4'   8   RC   H1'   2.17   3.46
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 235, r1= 1.67, r2= 2.17, r3= 3.46, r4= 3.96,  &end
#
#    9   RA   H2'   9   RA   H1'   2.07   3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 284, 266, r1= 1.57, r2= 2.07, r3= 3.30, r4= 3.80,  &end
#
#    9   RA   H2'  10   RG    H8   1.80   5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 284, 302, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
#    9   RA   H3'   9   RA    H8   2.41   3.84
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 269, r1= 1.91, r2= 2.41, r3= 3.84, r4= 4.34,  &end
#
#    9   RA   H4'   9   RA   H1'   2.52   4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 263, 266, r1= 2.02, r2= 2.52, r3= 4.02, r4= 4.52,  &end
#
#   11   RG   H2'  11   RG   H1'   2.29   3.65
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 333, r1= 1.79, r2= 2.29, r3= 3.65, r4= 4.15,  &end
#
#   11   RG   H2'  12   RC    H6   1.98   3.16
 &rst
  ixpk= 0, nxpk= 0, iat= 352, 370, r1= 1.48, r2= 1.98, r3= 3.16, r4= 3.66,  &end
#
#   12   RC   H2'  12   RC   H1'   2.14   3.42
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 367, r1= 1.64, r2= 2.14, r3= 3.42, r4= 3.92,  &end
#
#   12   RC   H2'  12   RC    H6   3.20   5.10
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 370, r1= 2.70, r2= 3.20, r3= 5.10, r4= 5.60,  &end
#
#   12   RC   H2'  13   RC    H6   1.83   2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 401, r1= 1.33, r2= 1.83, r3= 2.92, r4= 3.42,  &end
#
#   12   RC   H3'  12   RC    H6   2.01   3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 370, r1= 1.51, r2= 2.01, r3= 3.20, r4= 3.70,  &end
#
#   13   RC   H3'  13   RC   H1'   2.46   3.92
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 398, r1= 1.96, r2= 2.46, r3= 3.92, r4= 4.42,  &end
#
#   13   RC   H3'  13   RC    H6   1.86   2.96
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 401, r1= 1.36, r2= 1.86, r3= 2.96, r4= 3.46,  &end
#
#   13   RC   H4'  13   RC   H1'   2.41   3.84
 &rst
  ixpk= 0, nxpk= 0, iat= 395, 398, r1= 1.91, r2= 2.41, r3= 3.84, r4= 4.34,  &end
#
#   28   RG   H2'  28   RG    H8   2.91   4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 901, 885, r1= 2.41, r2= 2.91, r3= 4.64, r4= 5.14,  &end
#
#   28   RG   H2'  29   RG   H1'   3.42   5.46
 &rst
  ixpk= 0, nxpk= 0, iat= 901, 916, r1= 2.92, r2= 3.42, r3= 5.46, r4= 5.96,  &end
#
#   28   RG   H2'  29   RG    H8   1.96   3.13
 &rst
  ixpk= 0, nxpk= 0, iat= 901, 919, r1= 1.46, r2= 1.96, r3= 3.13, r4= 3.63,  &end
#
#   28   RG   H3'  28   RG   H1'   2.54   4.05
 &rst
  ixpk= 0, nxpk= 0, iat= 899, 882, r1= 2.04, r2= 2.54, r3= 4.05, r4= 4.55,  &end
#
#   28   RG   H3'  28   RG    H8   2.28   3.64
 &rst
  ixpk= 0, nxpk= 0, iat= 899, 885, r1= 1.78, r2= 2.28, r3= 3.64, r4= 4.14,  &end
#
#   28   RG   H3'  29   RG    H8   2.59   4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 899, 919, r1= 2.09, r2= 2.59, r3= 4.13, r4= 4.63,  &end
#
#   28   RG   H4'  28   RG   H1'   2.51   4.01
 &rst
  ixpk= 0, nxpk= 0, iat= 879, 882, r1= 2.01, r2= 2.51, r3= 4.01, r4= 4.51,  &end
#
#   29   RG   H2'  29   RG    H8   3.49   5.57
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 919, r1= 2.99, r2= 3.49, r3= 5.57, r4= 6.07,  &end
#
#   29   RG   H2'  30   RG   H1'   3.45   5.51
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 950, r1= 2.95, r2= 3.45, r3= 5.51, r4= 6.01,  &end
#
#   29   RG   H2'  30   RG    H8   1.96   3.12
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 953, r1= 1.46, r2= 1.96, r3= 3.12, r4= 3.62,  &end
#
#   29   RG   H3'  29   RG    H8   2.22   3.54
 &rst
  ixpk= 0, nxpk= 0, iat= 933, 919, r1= 1.72, r2= 2.22, r3= 3.54, r4= 4.04,  &end
#
#   29   RG   H3'  30   RG    H8   2.67   4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 933, 953, r1= 2.17, r2= 2.67, r3= 4.26, r4= 4.76,  &end
#
#   30   RG   H2'  30   RG   H1'   2.19   3.49
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 950, r1= 1.69, r2= 2.19, r3= 3.49, r4= 3.99,  &end
#
#   30   RG   H2'  31   RA    H8   1.97   3.14
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 987, r1= 1.47, r2= 1.97, r3= 3.14, r4= 3.64,  &end
#
#   30   RG   H3'  30   RG   H1'   3.15   5.03
 &rst
  ixpk= 0, nxpk= 0, iat= 967, 950, r1= 2.65, r2= 3.15, r3= 5.03, r4= 5.53,  &end
#
#   30   RG   H3'  30   RG    H8   2.27   3.63
 &rst
  ixpk= 0, nxpk= 0, iat= 967, 953, r1= 1.77, r2= 2.27, r3= 3.63, r4= 4.13,  &end
#
#   30   RG   H3'  31   RA    H8   2.95   4.71
 &rst
  ixpk= 0, nxpk= 0, iat= 967, 987, r1= 2.45, r2= 2.95, r3= 4.71, r4= 5.21,  &end
#
#   30   RG   H4'  30   RG   H1'   2.74   4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 947, 950, r1= 2.24, r2= 2.74, r3= 4.37, r4= 4.87,  &end
#
#   31   RA   H2'  31   RA   H1'   2.06   3.29
 &rst
  ixpk= 0, nxpk= 0, iat=1002, 984, r1= 1.56, r2= 2.06, r3= 3.29, r4= 3.79,  &end
#
#   31   RA   H3'  31   RA   H1'   3.02   4.81
 &rst
  ixpk= 0, nxpk= 0, iat=1000, 984, r1= 2.52, r2= 3.02, r3= 4.81, r4= 5.31,  &end
#
#   31   RA   H3'  31   RA    H8   2.20   3.50
 &rst
  ixpk= 0, nxpk= 0, iat=1000, 987, r1= 1.70, r2= 2.20, r3= 3.50, r4= 4.00,  &end
#
#   31   RA   H4'  31   RA   H1'   2.64   4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 981, 984, r1= 2.14, r2= 2.64, r3= 4.21, r4= 4.71,  &end
#
#   32   RG   H2'  33   RU    H6   1.93   3.07
 &rst
  ixpk= 0, nxpk= 0, iat=1036,1054, r1= 1.43, r2= 1.93, r3= 3.07, r4= 3.57,  &end
#
#   32   RG   H3'  33   RU    H6   2.54   4.04
 &rst
  ixpk= 0, nxpk= 0, iat=1034,1054, r1= 2.04, r2= 2.54, r3= 4.04, r4= 4.54,  &end
#
#   33   RU   H2'  34   RG   H1'   2.88   4.59
 &rst
  ixpk= 0, nxpk= 0, iat=1066,1081, r1= 2.38, r2= 2.88, r3= 4.59, r4= 5.09,  &end
#
#   33   RU   H2'  34   RG    H8   1.85   2.95
 &rst
  ixpk= 0, nxpk= 0, iat=1066,1084, r1= 1.35, r2= 1.85, r3= 2.95, r4= 3.45,  &end
#
#   33   RU   H3'  33   RU   H1'   2.50   4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1064,1051, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  &end
#
#   33   RU   H3'  33   RU    H6   1.92   3.06
 &rst
  ixpk= 0, nxpk= 0, iat=1064,1054, r1= 1.42, r2= 1.92, r3= 3.06, r4= 3.56,  &end
#
#   34   RG   H2'  34   RG    H8   2.77   4.42
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1084, r1= 2.27, r2= 2.77, r3= 4.42, r4= 4.92,  &end
#
#   34   RG   H2'  35   RC   H1'   2.93   4.67
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1115, r1= 2.43, r2= 2.93, r3= 4.67, r4= 5.17,  &end
#
#   34   RG   H2'  35   RC    H6   1.93   3.07
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1118, r1= 1.43, r2= 1.93, r3= 3.07, r4= 3.57,  &end
#
#   34   RG   H3'  34   RG    H8   2.00   3.19
 &rst
  ixpk= 0, nxpk= 0, iat=1098,1084, r1= 1.50, r2= 2.00, r3= 3.19, r4= 3.69,  &end
#
#   35   RC   H3'  35   RC    H6   1.98   3.16
 &rst
  ixpk= 0, nxpk= 0, iat=1129,1118, r1= 1.48, r2= 1.98, r3= 3.16, r4= 3.66,  &end
#
#    8   RC   H1'   8   RC    H6   3.03   4.82
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 238, r1= 2.53, r2= 3.03, r3= 4.82, r4= 5.32, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#    8   RC   H3'   8   RC   H1'   2.52   4.02
 &rst
  ixpk= 0, nxpk= 0, iat= 249, 235, r1= 2.02, r2= 2.52, r3= 4.02, r4= 4.52,  &end
#
#   10   RG   H1'  10   RG    H8   2.39   3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 299, 302, r1= 1.89, r2= 2.39, r3= 3.80, r4= 4.30,  &end
#
#   11   RG   H1'  11   RG    H8   3.20   4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 333, 336, r1= 2.70, r2= 3.20, r3= 4.10, r4= 4.60,  &end
#
#   12   RC   H1'  12   RC    H6   3.20   4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 370, r1= 2.70, r2= 3.20, r3= 4.10, r4= 4.60,  &end
#
#   13   RC   H1'  13   RC    H6   3.54   5.65
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 401, r1= 3.04, r2= 3.54, r3= 5.65, r4= 6.15,  &end
#
#   29   RG   H2'  29   RG   H1'   1.94   3.09
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 916, r1= 1.44, r2= 1.94, r3= 3.09, r4= 3.59,  &end
#
#   29   RG   H3'  29   RG   H1'   2.50   4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 933, 916, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  &end
#
#   31   RA   H2'  32   RG    H8   2.50   3.99
 &rst
  ixpk= 0, nxpk= 0, iat=1002,1020, r1= 2.00, r2= 2.50, r3= 3.99, r4= 4.49,  &end
#
#   32   RG   H1'  31   RA    H2   2.77   4.42
 &rst
  ixpk= 0, nxpk= 0, iat=1017, 996, r1= 2.27, r2= 2.77, r3= 4.42, r4= 4.92,  &end
#
#   34   RG   H1'   9   RA    H2   3.24   5.17
 &rst
  ixpk= 0, nxpk= 0, iat=1081, 278, r1= 2.74, r2= 3.24, r3= 5.17, r4= 5.67,  &end
#
#   34   RG   H2'  34   RG   H1'   1.89   3.01
 &rst
  ixpk= 0, nxpk= 0, iat=1100,1081, r1= 1.39, r2= 1.89, r3= 3.01, r4= 3.51,  &end
#
#   34   RG   H3'  34   RG   H1'   2.45   3.91
 &rst
  ixpk= 0, nxpk= 0, iat=1098,1081, r1= 1.95, r2= 2.45, r3= 3.91, r4= 4.41,  &end
#
#   34   RG   H3'  35   RC    H6   2.37   3.78
 &rst
  ixpk= 0, nxpk= 0, iat=1098,1118, r1= 1.87, r2= 2.37, r3= 3.78, r4= 4.28,  &end
#
#   35   RC   H1'  35   RC    H6   3.03   4.84
 &rst
  ixpk= 0, nxpk= 0, iat=1115,1118, r1= 2.53, r2= 3.03, r3= 4.84, r4= 5.34,  &end
#
#    9   RA    H2  33   RU    H3   1.54   3.60
 &rst
  ixpk= 0, nxpk= 0, iat= 278,1060, r1= 1.04, r2= 1.54, r3= 3.60, r4= 4.10, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#    9   RA    H2  34   RG    H1   2.51   5.87
 &rst
  ixpk= 0, nxpk= 0, iat= 278,1090, r1= 2.01, r2= 2.51, r3= 5.87, r4= 6.37,  &end
#
#   12   RC   H1'  11   RG    H1   2.13   4.97
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 342, r1= 1.63, r2= 2.13, r3= 4.97, r4= 5.47,  &end
#
#   12   RC   H41  30   RG    H1   1.29   3.01
 &rst
  ixpk= 0, nxpk= 0, iat= 375, 959, r1= 0.79, r2= 1.29, r3= 3.01, r4= 3.51,  &end
#
#   13   RC   H1'  30   RG    H1   2.65   6.17
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 959, r1= 2.15, r2= 2.65, r3= 6.17, r4= 6.67,  &end
#
#   30   RG   H1'  29   RG    H1   2.05   4.79
 &rst
  ixpk= 0, nxpk= 0, iat= 950, 925, r1= 1.55, r2= 2.05, r3= 4.79, r4= 5.29,  &end
#
#   31   RA    H2  11   RG    H1   1.66   3.88
 &rst
  ixpk= 0, nxpk= 0, iat= 996, 342, r1= 1.16, r2= 1.66, r3= 3.88, r4= 4.38,  &end
#
#   11   RG   H22  31   RA    H2   1.80   3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 996, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#    5   RU   H1'   4   RU    H3   3.15   7.35
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 120, r1= 2.65, r2= 3.15, r3= 7.35, r4= 7.85, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#    6   RU    H5   5   RU    H3   3.39   7.93
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 150, r1= 2.89, r2= 3.39, r3= 7.93, r4= 8.43,  &end
#
#   28   RG    H1  14   RU    H3   1.37   3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 891, 438, r1= 0.87, r2= 1.37, r3= 3.21, r4= 3.71,  &end
#
#   37   RG    H1   5   RU    H3   1.86   4.34
 &rst
  ixpk= 0, nxpk= 0, iat=1188, 150, r1= 1.36, r2= 1.86, r3= 4.34, r4= 4.84,  &end
#
#   37   RG    N2   5   RU    H3   3.00   6.00
 &rst
  ixpk= 0, nxpk= 0, iat=1190, 150, r1= 2.50, r2= 3.00, r3= 6.00, r4= 6.50,  &end
#
#    3   RA    H2  39  RU3    H3   2.41   5.61
 &rst
  ixpk= 0, nxpk= 0, iat=  90,1255, r1= 1.91, r2= 2.41, r3= 5.61, r4= 6.11, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#    5   RU    H3   4   RU    H3   2.44   5.70
 &rst
  ixpk= 0, nxpk= 0, iat= 150, 120, r1= 1.94, r2= 2.44, r3= 5.70, r4= 6.20,  &end
#
#    5   RU    H3   6   RU    H3   2.73   6.35
 &rst
  ixpk= 0, nxpk= 0, iat= 150, 180, r1= 2.23, r2= 2.73, r3= 6.35, r4= 6.85,  &end
#
#    6   RU   H1'  37   RG    H1   2.29   5.33
 &rst
  ixpk= 0, nxpk= 0, iat= 171,1188, r1= 1.79, r2= 2.29, r3= 5.33, r4= 5.83,  &end
#
#    7   RG    H1   6   RU    H3   3.04   7.10
 &rst
  ixpk= 0, nxpk= 0, iat= 210, 180, r1= 2.54, r2= 3.04, r3= 7.10, r4= 7.60,  &end
#
#    7   RG   H1'   6   RU    H3   3.00   8.00
 &rst
  ixpk= 0, nxpk= 0, iat= 201, 180, r1= 2.50, r2= 3.00, r3= 8.00, r4= 8.50,  &end
#
#    7   RG    N2   6   RU    H3   3.00   7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 212, 180, r1= 2.50, r2= 3.00, r3= 7.00, r4= 7.50,  &end
#
#   14   RU   H1'  14   RU    H3   2.90   6.78
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 438, r1= 2.40, r2= 2.90, r3= 6.78, r4= 7.28,  &end
#
#   14   RU   H1'  28   RG    H1   2.92   6.80
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 891, r1= 2.42, r2= 2.92, r3= 6.80, r4= 7.30,  &end
#
#   14   RU   H1'  29   RG    H1   2.09   4.89
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 925, r1= 1.59, r2= 2.09, r3= 4.89, r4= 5.39,  &end
#
#   14   RU    H3  29   RG    H1   2.45   5.71
 &rst
  ixpk= 0, nxpk= 0, iat= 438, 925, r1= 1.95, r2= 2.45, r3= 5.71, r4= 6.21,  &end
#
#   15   RA   H1'  14   RU    H3   2.84   6.62
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 438, r1= 2.34, r2= 2.84, r3= 6.62, r4= 7.12,  &end
#
#   15   RA   H1'  28   RG    H1   2.15   5.03
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 891, r1= 1.65, r2= 2.15, r3= 5.03, r4= 5.53,  &end
#
#   15   RA    H2  14   RU    H3   3.39   7.91
 &rst
  ixpk= 0, nxpk= 0, iat= 471, 438, r1= 2.89, r2= 3.39, r3= 7.91, r4= 8.41,  &end
#
#   15   RA    H2  28   RG    H1   3.10   7.22
 &rst
  ixpk= 0, nxpk= 0, iat= 471, 891, r1= 2.60, r2= 3.10, r3= 7.22, r4= 7.72,  &end
#
#   28   RG    H1  14   RU    H3   1.66   3.86
 &rst
  ixpk= 0, nxpk= 0, iat= 891, 438, r1= 1.16, r2= 1.66, r3= 3.86, r4= 4.36,  &end
#
#   28   RG    H1  29   RG    H1   2.75   6.41
 &rst
  ixpk= 0, nxpk= 0, iat= 891, 925, r1= 2.25, r2= 2.75, r3= 6.41, r4= 6.91,  &end
#
#   28   RG    N2  14   RU    H3   3.00   6.00
 &rst
  ixpk= 0, nxpk= 0, iat= 893, 438, r1= 2.50, r2= 3.00, r3= 6.00, r4= 6.50,  &end
#
#   28   RG    N2  29   RG    H1   3.00   7.00
 &rst
  ixpk= 0, nxpk= 0, iat= 893, 925, r1= 2.50, r2= 3.00, r3= 7.00, r4= 7.50,  &end
#
#   29   RG   H1'  14   RU    H3   3.00   8.00
 &rst
  ixpk= 0, nxpk= 0, iat= 916, 438, r1= 2.50, r2= 3.00, r3= 8.00, r4= 8.50,  &end
#
#   35   RC    N4   6   RU    H3   2.59   7.03
 &rst
  ixpk= 0, nxpk= 0, iat=1122, 180, r1= 2.09, r2= 2.59, r3= 7.03, r4= 7.53,  &end
#
#   36   RA   H1'   6   RU    H3   3.00   8.00
 &rst
  ixpk= 0, nxpk= 0, iat=1146, 180, r1= 2.50, r2= 3.00, r3= 8.00, r4= 8.50,  &end
#
#   37   RG    H1   4   RU    H3   3.31   7.73
 &rst
  ixpk= 0, nxpk= 0, iat=1188, 120, r1= 2.81, r2= 3.31, r3= 7.73, r4= 8.23,  &end
#
#   37   RG    H1   6   RU    H3   2.62   6.12
 &rst
  ixpk= 0, nxpk= 0, iat=1188, 180, r1= 2.12, r2= 2.62, r3= 6.12, r4= 6.62,  &end
#
#   37   RG   H1'   6   RU    H3   2.71   6.31
 &rst
  ixpk= 0, nxpk= 0, iat=1179, 180, r1= 2.21, r2= 2.71, r3= 6.31, r4= 6.81,  &end
#
#   39  RU3   H1'   4   RU    H3   3.05   7.11
 &rst
  ixpk= 0, nxpk= 0, iat=1246, 120, r1= 2.55, r2= 3.05, r3= 7.11, r4= 7.61,  &end
#
#    3   RA   H1'   3   RA    H8   3.00   7.00
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  81, r1= 2.50, r2= 3.00, r3= 7.00, r4= 7.50, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#    3   RA   H2'   3   RA   H1'   1.95   4.57
 &rst
  ixpk= 0, nxpk= 0, iat=  96,  78, r1= 1.45, r2= 1.95, r3= 4.57, r4= 5.07,  &end
#
#    3   RA   H2'   3   RA    H8   2.00   4.50
 &rst
  ixpk= 0, nxpk= 0, iat=  96,  81, r1= 1.50, r2= 2.00, r3= 4.50, r4= 5.00,  &end
#
#    4   RU   H1'   3   RA    H2   2.00   5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 111,  90, r1= 1.50, r2= 2.00, r3= 5.00, r4= 5.50,  &end
#
#    4   RU   H1'   4   RU    H6   2.00   5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 111, 114, r1= 1.50, r2= 2.00, r3= 5.00, r4= 5.50,  &end
#
#    4   RU   H2'   4   RU   H1'   1.94   4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 126, 111, r1= 1.44, r2= 1.94, r3= 4.52, r4= 5.02,  &end
#
#    5   RU   H1'  38   RA    H2   2.06   4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 141,1225, r1= 1.56, r2= 2.06, r3= 4.80, r4= 5.30,  &end
#
#    7   RG   H1'  36   RA    H2   2.15   5.01
 &rst
  ixpk= 0, nxpk= 0, iat= 201,1158, r1= 1.65, r2= 2.15, r3= 5.01, r4= 5.51,  &end
#
#    7   RG   H2'   8   RC    H6   1.80   4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 220, 238, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13   RC   H2'  14   RU    H6   1.37   3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 414, 432, r1= 0.87, r2= 1.37, r3= 3.21, r4= 3.71,  &end
#
#   14   RU   H1'  14   RU    H6   2.00   4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 429, 432, r1= 1.50, r2= 2.00, r3= 4.66, r4= 5.16,  &end
#
#   14   RU   H2'  14   RU    H6   1.83   4.27
 &rst
  ixpk= 0, nxpk= 0, iat= 444, 432, r1= 1.33, r2= 1.83, r3= 4.27, r4= 4.77,  &end
#
#   14   RU   H2'  15   RA    H8   1.31   3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 444, 462, r1= 0.81, r2= 1.31, r3= 3.05, r4= 3.55,  &end
#
#   14   RU    H5  13   RC    H6   2.24   5.24
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 401, r1= 1.74, r2= 2.24, r3= 5.24, r4= 5.74,  &end
#
#   15   RA    H8  14   RU    H6   2.71   6.33
 &rst
  ixpk= 0, nxpk= 0, iat= 462, 432, r1= 2.21, r2= 2.71, r3= 6.33, r4= 6.83,  &end
#
#   15   RA   H1'  15   RA    H8   2.32   5.42
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 462, r1= 1.82, r2= 2.32, r3= 5.42, r4= 5.92,  &end
#
#   15   RA   H1'  28   RG    N2   2.00   4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 893, r1= 1.50, r2= 2.00, r3= 4.00, r4= 4.50,  &end
#
#   15   RA   H2'  15   RA   H1'   2.00   3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 477, 459, r1= 1.50, r2= 2.00, r3= 3.50, r4= 4.00,  &end
#
#   15   RA   H2'  15   RA    H8   2.00   4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 477, 462, r1= 1.50, r2= 2.00, r3= 4.50, r4= 5.00,  &end
#
#   15   RA   H2'  16   RC    H6   2.00   4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 477, 495, r1= 1.50, r2= 2.00, r3= 4.00, r4= 4.50,  &end
#
#   16   RC   H1'  15   RA    H2   1.81   4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 492, 471, r1= 1.31, r2= 1.81, r3= 4.21, r4= 4.71,  &end
#
#   17   RC   H1'  26   RA    H2   3.00   5.50
 &rst
  ixpk= 0, nxpk= 0, iat= 523, 831, r1= 2.50, r2= 3.00, r3= 5.50, r4= 6.00,  &end
#
#   23   RC    H5  18   RA    H2   2.20   6.12
 &rst
  ixpk= 0, nxpk= 0, iat= 725, 566, r1= 1.70, r2= 2.20, r3= 6.12, r4= 6.62,  &end
#
#   25   RG   H2'  27   RU    H6   4.00  103.00
 &rst
  ixpk= 0, nxpk= 0, iat= 804, 855, r1= 3.50, r2= 4.00, r3=103.00, r4=103.50,  &end
#
#   26   RA   H1'  26   RA    H8   2.63   6.13
 &rst
  ixpk= 0, nxpk= 0, iat= 819, 822, r1= 2.13, r2= 2.63, r3= 6.13, r4= 6.63,  &end
#
#   26   RA   H2'  26   RA   H1'   1.63   3.79
 &rst
  ixpk= 0, nxpk= 0, iat= 837, 819, r1= 1.13, r2= 1.63, r3= 3.79, r4= 4.29,  &end
#
#   27   RU   H1'  27   RU    H6   2.02   4.72
 &rst
  ixpk= 0, nxpk= 0, iat= 852, 855, r1= 1.52, r2= 2.02, r3= 4.72, r4= 5.22,  &end
#
#   27   RU   H2'  27   RU   H1'   2.00   3.50
 &rst
  ixpk= 0, nxpk= 0, iat= 867, 852, r1= 1.50, r2= 2.00, r3= 3.50, r4= 4.00,  &end
#
#   27   RU    H5  26   RA    H8   2.44   5.70
 &rst
  ixpk= 0, nxpk= 0, iat= 857, 822, r1= 1.94, r2= 2.44, r3= 5.70, r4= 6.20,  &end
#
#   26   RA    H8  27   RU    H6   2.44   5.70
 &rst
  ixpk= 0, nxpk= 0, iat= 822, 855, r1= 1.94, r2= 2.44, r3= 5.70, r4= 6.20,  &end
#
#   28   RG   H1'  15   RA    H2   1.91   4.47
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 471, r1= 1.41, r2= 1.91, r3= 4.47, r4= 4.97,  &end
#
#   29   RG   H1'  28   RG    N2   2.00   4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 916, 893, r1= 1.50, r2= 2.00, r3= 4.00, r4= 4.50,  &end
#
#   35   RC   H2'  36   RA    H8   1.80   4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1131,1149, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   36   RA   H1'  36   RA    H8   2.54   5.94
 &rst
  ixpk= 0, nxpk= 0, iat=1146,1149, r1= 2.04, r2= 2.54, r3= 5.94, r4= 6.44,  &end
#
#   36   RA   H2'  36   RA   H1'   1.47   3.43
 &rst
  ixpk= 0, nxpk= 0, iat=1164,1146, r1= 0.97, r2= 1.47, r3= 3.43, r4= 3.93,  &end
#
#   36   RA   H2'  37   RG    H8   1.52   3.54
 &rst
  ixpk= 0, nxpk= 0, iat=1164,1182, r1= 1.02, r2= 1.52, r3= 3.54, r4= 4.04,  &end
#
#   37   RG   H1'  36   RA    H2   2.77   6.47
 &rst
  ixpk= 0, nxpk= 0, iat=1179,1158, r1= 2.27, r2= 2.77, r3= 6.47, r4= 6.97,  &end
#
#   38   RA   H1'  37   RG    N2   2.00   4.00
 &rst
  ixpk= 0, nxpk= 0, iat=1213,1190, r1= 1.50, r2= 2.00, r3= 4.00, r4= 4.50,  &end
#
#   38   RA   H2'  39  RU3    H6   2.00   4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1231,1249, r1= 1.50, r2= 2.00, r3= 4.50, r4= 5.00,  &end
#
#   39  RU3   H1'  39  RU3    H6   2.41   5.63
 &rst
  ixpk= 0, nxpk= 0, iat=1246,1249, r1= 1.91, r2= 2.41, r3= 5.63, r4= 6.13,  &end
#
#   39  RU3   H2'  39  RU3   H1'   1.96   4.56
 &rst
  ixpk= 0, nxpk= 0, iat=1261,1246, r1= 1.46, r2= 1.96, r3= 4.56, r4= 5.06,  &end
#
#   39  RU3   H2'  39  RU3    H6   2.00   4.50
 &rst
  ixpk= 0, nxpk= 0, iat=1261,1249, r1= 1.50, r2= 2.00, r3= 4.50, r4= 5.00,  &end
#
#    3   RA    N1  39  RU3    H3   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat=  88,1255, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, 
      rk2=30.0, rk3=30.0, ir6=1, ialtd=0,
 &end
#
#    3   RA   H61  39  RU3    O4   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat=  86,1253, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    4   RU    H3  38   RA    N1   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 120,1223, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    4   RU    O4  38   RA   H61   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 118,1221, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    5   RU    H3  37   RG    O6   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 150,1186, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    5   RU    O2  37   RG    H1   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 152,1188, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    6   RU    H3  36   RA    N1   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 180,1156, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    6   RU    O4  36   RA   H61   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 178,1154, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    7   RG    H1  35   RC    N3   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 210,1125, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    7   RG    O6  35   RC   H41   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 208,1123, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    7   RG   H22  35   RC    O2   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 214,1127, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    8   RC    N3  34   RG    H1   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 245,1090, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    8   RC   H41  34   RG    O6   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 243,1088, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    8   RC    O2  34   RG   H22   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 247,1094, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    9   RA    N1  33   RU    H3   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 276,1060, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    9   RA   H61  33   RU    O4   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 274,1058, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   12   RC    N3  30   RG    H1   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 377, 959, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   12   RC   H41  30   RG    O6   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 375, 957, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   12   RC    O2  30   RG   H22   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 963, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   13   RC    N3  29   RG    H1   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 408, 925, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   13   RC   H41  29   RG    O6   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 406, 923, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   13   RC    O2  29   RG   H22   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 929, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   14   RU    H3  28   RG    O6   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 438, 889, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   14   RU    O2  28   RG    H1   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 891, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   15   RA    N1  27   RU    H3   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 469, 861, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   15   RA   H61  27   RU    O4   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 467, 859, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   16   RC    N3  25   RG    H1   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 502, 794, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   16   RC   H41  25   RG    O6   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 500, 792, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   16   RC    O2  25   RG   H22   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 504, 798, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   17   RC    N3  24   RG    H1   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 533, 760, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   17   RC   H41  24   RG    O6   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 531, 758, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#   17   RC    O2  24   RG   H22   1.80   2.40
 &rst
  ixpk= 0, nxpk= 0, iat= 535, 764, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#    1  RG5    H1   1  RG5   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat=  19,  23, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#    2   RG    H1   2   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat=  53,  57, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#    7   RG    H1   7   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat= 210, 214, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   10   RG    H1  10   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat= 308, 312, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   11   RG    H1  11   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat= 342, 346, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   19   RG    H1  19   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat= 596, 600, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   24   RG    H1  24   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat= 760, 764, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   25   RG    H1  25   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat= 794, 798, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   28   RG    H1  28   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat= 891, 895, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   29   RG    H1  29   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat= 925, 929, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   30   RG    H1  30   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat= 959, 963, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   32   RG    H1  32   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat=1026,1030, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   34   RG    H1  34   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat=1090,1094, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#   37   RG    H1  37   RG   H22   1.80   2.50
 &rst
  ixpk= 0, nxpk= 0, iat=1188,1192, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
#    8   RC    H5   8   RC   H42   1.80   2.70
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 244, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   12   RC    H5  12   RC   H42   1.80   2.70
 &rst
  ixpk= 0, nxpk= 0, iat= 372, 376, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   13   RC    H5  13   RC   H42   1.80   2.70
 &rst
  ixpk= 0, nxpk= 0, iat= 403, 407, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   16   RC    H5  16   RC   H42   1.80   2.70
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 501, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   17   RC    H5  17   RC   H42   1.80   2.70
 &rst
  ixpk= 0, nxpk= 0, iat= 528, 532, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   23   RC    H5  23   RC   H42   1.80   2.70
 &rst
  ixpk= 0, nxpk= 0, iat= 725, 729, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#   35   RC    H5  35   RC   H42   1.80   2.70
 &rst
  ixpk= 0, nxpk= 0, iat=1120,1124, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#    3   RA    N7   3   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat=  82,  87, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#    9   RA    N7   9   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 275, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#   15   RA    N7  15   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 468, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#   18   RA    N7  18   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 558, 563, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#   20   RA    N7  20   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 630, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#   21   RA    N7  21   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 663, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#   22   RA    N7  22   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 696, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#   26   RA    N7  26   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 823, 828, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#   31   RA    N7  31   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 988, 993, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#   36   RA    N7  36   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat=1150,1155, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#   38   RA    N7  38   RA   H62   1.80   3.10
 &rst
  ixpk= 0, nxpk= 0, iat=1217,1222, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end


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