home *** CD-ROM | disk | FTP | other *** search
- ; Stick colour
- 2(0.700000, 0.700000, 0.700000)
- ; Model
- BS
- ; Definitions
- C = 31.292262, 12.516905(0.500000, 0.500000, 0.500000)
- H = 18.775357, 7.510143(1.000000, 1.000000, 1.000000)
- N = 31.292262, 12.516905(0.000000, 0.000000, 1.000000)
- O = 29.206111, 12.099674(1.000000, 0.000000, 0.000000)
- ; Instances
- N101 : -17.333563 -170.536173 -96.629786
- C102 : -6.342357 -165.389230 -68.639260
- C103 : -20.669385 -137.628931 -60.165113
- O104 : -18.773701 -118.571197 -78.241450
- C105 : 25.696688 -163.704362 -69.382722
- H106 : -7.619504 -158.133836 -111.182444
- H107 : -11.256902 -182.443301 -55.133846
- N108 : -32.580269 -135.407752 -36.070971
- C109 : -45.768993 -110.768444 -23.604149
- C110 : -26.355591 -95.397240 -4.220404
- O111 : -15.893509 -107.867213 15.895927
- C112 : -70.407397 -121.991231 -6.176969
- H113 : -32.523732 -151.099551 -22.766542
- H114 : -56.899792 -98.119400 -38.285155
- N115 : -18.488455 -69.818661 -8.637212
- C116 : -1.647010 -52.302939 9.412070
- C117 : -18.910519 -26.694270 18.176647
- O118 : -27.649115 -9.781292 0.810224
- C119 : 25.458788 -43.650851 -5.362811
- H120 : -26.633263 -58.803151 -24.673605
- H121 : 4.421032 -63.345009 28.075203
- N122 : -23.275301 -21.676671 44.740160
- C123 : -38.755146 1.794565 57.194985
- C124 : -18.406742 24.297868 65.162941
- O125 : 4.998954 17.347602 76.560972
- C126 : -57.930415 -10.890890 79.052421
- H127 : -15.834007 -34.612625 59.364228
- H128 : -52.678372 9.529892 41.426245
- N129 : -23.082672 50.746479 57.363271
- C130 : -4.398074 73.766134 65.520751
- C131 : -20.438261 101.484692 65.939514
- O132 : -44.999460 103.138126 58.194720
- C133 : 21.660703 78.054429 48.400540
- H134 : -41.760358 54.602211 48.507294
- H135 : 3.221985 68.226220 86.134278
- N136 : -7.518320 123.093175 75.749534
- C137 : -14.984369 152.245571 78.965816
- C138 : 8.039694 168.484760 63.707503
- O139 : 31.002873 169.370664 76.140968
- C140 : -18.207906 163.186213 108.816690
- H141 : 12.185833 120.801254 82.136638
- H142 : -34.635234 157.413573 70.225835
- N143 : 2.108084 180.925753 40.658018
- ; Bonds
- N101, C102
- C102, C103
- C103, O104
- C102, H107
- C102, C105
- N101, H106
- C103, N108
- N108, C109
- C109, C110
- C110, O111
- C109, H114
- C109, C112
- N108, H113
- C110, N115
- N115, C116
- C116, C117
- C117, O118
- C116, H121
- C116, C119
- N115, H120
- C117, N122
- N122, C123
- C123, C124
- C124, O125
- C123, H128
- C123, C126
- N122, H127
- C124, N129
- N129, C130
- C130, C131
- C131, O132
- C130, H135
- C130, C133
- N129, H134
- C131, N136
- N136, C137
- C137, C138
- C138, O139
- C137, H142
- C137, C140
- N136, H141
- C138, N143
-