0 mol 1 unq 0 iso 0 dist 8.40848 8.27735 6.35409 5.27206 12.2079 9.00903 6.03793 7.90928 8.56884 9.01967 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.3793 7.25179 5.53103 13.7 12.8229 8.57077 6.62605 11.2859 6.85412 8.27962 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.3793 7.25179 5.53103 13.7 12.8229 8.57077 4.75933 10.6683 6.33889 11.4878 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 6.42206 7.34549 5.3315 4.76147 6.88695 8.34347 7.23551 9.97117 6.73162 7.23546 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 9.66602 9.72289 5.3315 5.93227 6.88695 8.34347 8.34836 9.97117 6.73162 7.23546 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 8.60396 8.47617 12.7554 15.1595 20.7027 8.80331 10.7814 14.5682 9.83618 10.4442 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 8.60396 8.47617 12.7554 8.14351 15.6909 6.20293 10.7814 14.5682 9.83618 9.49077 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 8.21127 5.11612 6.75472 10.3475 12.5189 9.33865 5.39389 13.1716 7.76729 10.7942 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 8.21127 5.11612 6.75472 6.86762 5.02717 5.83991 5.39389 13.1716 7.76729 10.9739 numMergedOcc 0
9 mol 115 unq 2 iso 0 dist 7.99121 5.22628 6.59772 10.0419 12.6493 9.33865 9.16391 9.44544 9.66954 6.09023 numMergedOcc 0
10 mol 115 unq 3 iso 0 dist 7.99121 5.22628 6.59772 10.0419 12.6493 9.33865 5.26498 12.7883 7.64585 10.2377 numMergedOcc 0
11 mol 115 unq 4 iso 0 dist 7.99121 5.22628 6.59772 6.8104 4.98864 6.11741 9.16391 9.44544 9.66954 4.61908 numMergedOcc 0
12 mol 115 unq 5 iso 0 dist 7.99121 5.22628 6.59772 6.8104 4.98864 6.11741 5.26498 12.7883 7.64585 10.8939 numMergedOcc 0
13 mol 115 unq 6 iso 0 dist 6.30982 5.22628 4.86477 10.0419 13.7044 9.33865 9.16391 12.2966 9.66954 6.09023 numMergedOcc 0
14 mol 115 unq 7 iso 0 dist 6.30982 5.22628 4.86477 10.0419 13.7044 9.33865 5.26498 10.1292 7.64585 10.2377 numMergedOcc 0
15 mol 115 unq 8 iso 0 dist 6.30982 5.22628 4.86477 6.8104 7.95871 6.11741 9.16391 12.2966 9.66954 4.61908 numMergedOcc 0
16 mol 115 unq 9 iso 0 dist 6.30982 5.22628 4.86477 6.8104 7.95871 6.11741 5.26498 10.1292 7.64585 10.8939 numMergedOcc 0
17 mol 115 unq 10 iso 0 dist 6.12404 5.22628 5.24961 10.0419 12.5192 9.33865 9.16391 13.8388 9.66954 6.09023 numMergedOcc 0
18 mol 115 unq 11 iso 0 dist 6.12404 5.22628 5.24961 10.0419 12.5192 9.33865 5.26498 5.58063 7.64585 10.2377 numMergedOcc 0
19 mol 115 unq 12 iso 0 dist 6.12404 5.22628 5.24961 6.8104 10.8398 6.11741 9.16391 13.8388 9.66954 4.61908 numMergedOcc 0
20 mol 115 unq 13 iso 0 dist 6.12404 5.22628 5.24961 6.8104 10.8398 6.11741 5.26498 5.58063 7.64585 10.8939 numMergedOcc 0
21 mol 133 unq 0 iso 0 dist 5.59311 8.94909 14.4095 8.76089 12.969 7.11802 11.1266 15.7784 7.92688 4.68409 numMergedOcc 0
22 mol 133 unq 1 iso 0 dist 5.59311 8.94909 14.4095 6.80087 9.84918 8.00618 11.1266 15.7784 7.92688 12.2037 numMergedOcc 0
23 mol 133 unq 2 iso 0 dist 9.22456 8.94909 17.145 8.76089 16.8036 7.11802 11.1266 20.0402 7.92688 4.68409 numMergedOcc 0
24 mol 133 unq 3 iso 0 dist 9.22456 8.94909 17.145 6.80087 11.3707 8.00618 11.1266 20.0402 7.92688 12.2037 numMergedOcc 0
25 mol 133 unq 4 iso 0 dist 5.7232 8.94909 5.37072 8.76089 9.50322 7.11802 11.1266 11.5756 7.92688 4.68409 numMergedOcc 0
26 mol 133 unq 5 iso 0 dist 5.7232 8.94909 5.37072 6.80087 5.82404 8.00618 11.1266 11.5756 7.92688 12.2037 numMergedOcc 0
27 mol 152 unq 0 iso 0 dist 8.30966 9.0847 12.2051 14.8573 19.6013 8.56324 12.6562 16.6439 9.13561 5.99333 numMergedOcc 0
28 mol 152 unq 1 iso 0 dist 8.30966 9.0847 12.2051 8.41711 15.3038 6.70283 12.6562 16.6439 9.13561 8.25411 numMergedOcc 0
29 mol 152 unq 2 iso 0 dist 8.30966 9.0847 12.2051 4.82496 10.8892 7.16148 12.6562 16.6439 9.13561 7.89109 numMergedOcc 0
30 mol 181 unq 0 iso 0 dist 8.94464 9.50454 9.32503 11.755 12.06 7.63312 10.9336 13.9657 6.93764 4.80231 numMergedOcc 0
31 mol 181 unq 1 iso 0 dist 8.94464 7.15963 13.2985 14.1493 18.4423 9.1374 9.09192 12.4394 6.94688 6.25083 numMergedOcc 0
32 mol 181 unq 2 iso 0 dist 8.94464 7.15963 13.2985 14.1493 18.4423 9.1374 12.1848 15.301 6.71012 4.77278 numMergedOcc 0
33 mol 181 unq 3 iso 0 dist 8.94464 7.15963 13.2985 6.73556 13.9813 5.98885 9.09192 12.4394 6.94688 5.86342 numMergedOcc 0
34 mol 181 unq 4 iso 0 dist 8.94464 7.15963 13.2985 6.73556 13.9813 5.98885 12.1848 15.301 6.71012 9.14057 numMergedOcc 0
35 mol 181 unq 5 iso 0 dist 8.94464 7.15963 13.2985 5.49666 10.498 9.15386 9.09192 12.4394 6.94688 6.80228 numMergedOcc 0
36 mol 181 unq 6 iso 0 dist 8.94464 7.15963 13.2985 5.49666 10.498 9.15386 12.1848 15.301 6.71012 11.6919 numMergedOcc 0
37 mol 181 unq 7 iso 0 dist 8.63713 9.50454 8.88398 11.755 15.5519 7.63312 10.9336 13.5592 6.93764 4.80231 numMergedOcc 0
38 mol 181 unq 8 iso 0 dist 8.63713 7.15963 4.98009 14.1493 12.0593 9.1374 9.09192 9.20477 6.94688 6.25083 numMergedOcc 0
39 mol 181 unq 9 iso 0 dist 8.63713 7.15963 4.98009 14.1493 12.0593 9.1374 12.1848 7.90237 6.71012 4.77278 numMergedOcc 0
40 mol 181 unq 10 iso 0 dist 8.63713 7.15963 4.98009 6.73556 10.3248 5.98885 9.09192 9.20477 6.94688 5.86342 numMergedOcc 0
41 mol 181 unq 11 iso 0 dist 8.63713 7.15963 4.98009 6.73556 10.3248 5.98885 12.1848 7.90237 6.71012 9.14057 numMergedOcc 0
42 mol 181 unq 12 iso 0 dist 8.63713 7.15963 4.98009 5.49666 11.7479 9.15386 9.09192 9.20477 6.94688 6.80228 numMergedOcc 0
43 mol 181 unq 13 iso 0 dist 8.63713 7.15963 4.98009 5.49666 11.7479 9.15386 12.1848 7.90237 6.71012 11.6919 numMergedOcc 0
44 mol 181 unq 14 iso 0 dist 5.08796 6.43406 4.3158 10.9813 9.84952 7.81386 4.56814 6.17129 4.93785 6.7991 numMergedOcc 0
45 mol 181 unq 15 iso 0 dist 5.93515 6.43406 4.3226 10.9813 10.8641 7.81386 4.56814 5.83596 4.93785 6.7991 numMergedOcc 0
46 mol 197 unq 0 iso 0 dist 8.61953 9.14737 10.5326 9.23779 15.4893 8.56633 7.69844 8.32685 8.99696 9.82139 numMergedOcc 0
47 mol 197 unq 1 iso 0 dist 8.61953 9.14737 10.5326 9.23779 15.4893 8.56633 15.0242 18.309 7.85058 8.72637 numMergedOcc 0
48 mol 197 unq 2 iso 0 dist 8.61953 9.14737 10.5326 9.23779 15.4893 8.56633 12.1399 15.9649 9.96638 5.69148 numMergedOcc 0
49 mol 197 unq 3 iso 0 dist 7.91999 9.14737 5.29309 9.23779 11.6279 8.56633 7.69844 6.74777 8.99696 9.82139 numMergedOcc 0
50 mol 197 unq 4 iso 0 dist 7.91999 9.14737 5.29309 9.23779 11.6279 8.56633 15.0242 13.021 7.85058 8.72637 numMergedOcc 0
51 mol 197 unq 5 iso 0 dist 7.91999 9.14737 5.29309 9.23779 11.6279 8.56633 12.1399 12.0882 9.96638 5.69148 numMergedOcc 0
52 mol 236 unq 0 iso 0 dist 4.43243 5.99137 4.15973 13.7629 12.3675 9.81562 4.47231 6.98151 5.34718 11.8759 numMergedOcc 0
53 mol 236 unq 1 iso 0 dist 4.43243 5.99137 4.15973 13.3575 11.0771 7.68742 4.47231 6.98151 5.34718 11.3552 numMergedOcc 0
54 mol 236 unq 2 iso 0 dist 4.43243 5.99137 4.15973 5.03598 5.66569 6.27581 4.47231 6.98151 5.34718 6.04825 numMergedOcc 0
55 mol 236 unq 3 iso 0 dist 5.92025 5.99137 9.01197 13.7629 14.8917 9.81562 4.47231 9.91572 5.34718 11.8759 numMergedOcc 0
56 mol 236 unq 4 iso 0 dist 5.92025 5.99137 9.01197 13.3575 15.2525 7.68742 4.47231 9.91572 5.34718 11.3552 numMergedOcc 0
57 mol 236 unq 5 iso 0 dist 5.92025 5.99137 9.01197 5.03598 6.11137 6.27581 4.47231 9.91572 5.34718 6.04825 numMergedOcc 0
58 mol 236 unq 6 iso 0 dist 9.04819 5.99137 14.6016 13.7629 22.3544 9.81562 4.47231 12.8714 5.34718 11.8759 numMergedOcc 0
59 mol 236 unq 7 iso 0 dist 9.04819 5.99137 14.6016 13.3575 22.146 7.68742 4.47231 12.8714 5.34718 11.3552 numMergedOcc 0
60 mol 236 unq 8 iso 0 dist 9.04819 5.99137 14.6016 5.03598 12.6124 6.27581 4.47231 12.8714 5.34718 6.04825 numMergedOcc 0
61 mol 259 unq 0 iso 0 dist 8.93002 6.20344 9.79538 5.56656 8.06771 7.88519 12.9748 13.1236 7.48005 11.6195 numMergedOcc 0
62 mol 259 unq 1 iso 0 dist 8.93002 6.20344 9.79538 6.08432 12.3795 7.84554 12.9748 13.1236 7.48005 11.8736 numMergedOcc 0
63 mol 259 unq 2 iso 0 dist 8.93002 6.20344 9.79538 10.3156 11.1503 7.46176 12.9748 13.1236 7.48005 5.79468 numMergedOcc 0
64 mol 259 unq 3 iso 0 dist 8.93002 6.20344 9.79538 9.55719 17.0226 9.18903 12.9748 13.1236 7.48005 12.6649 numMergedOcc 0
