0 mol 1 unq 0 iso 0 dist 8.40848 8.27735 6.35409 6.03793 7.90928 8.56884 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.3793 7.25179 5.53103 6.62605 11.2859 6.85412 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.3793 7.25179 5.53103 4.75933 10.6683 6.33889 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 6.42206 7.34549 5.3315 7.23551 9.97117 6.73162 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 9.66602 9.72289 5.3315 8.34836 9.97117 6.73162 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 8.60396 8.47617 12.7554 10.7814 14.5682 9.83618 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.7385 7.63534 6.35022 4.35757 12.2107 8.97793 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.7385 7.63534 6.35022 6.55474 10.6559 8.19682 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 8.21127 5.11612 6.75472 5.39389 13.1716 7.76729 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 7.99121 5.22628 6.59772 9.16391 9.44544 9.66954 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 7.99121 5.22628 6.59772 5.26498 12.7883 7.64585 numMergedOcc 0
11 mol 115 unq 3 iso 0 dist 6.30982 5.22628 4.86477 9.16391 12.2966 9.66954 numMergedOcc 0
12 mol 115 unq 4 iso 0 dist 6.30982 5.22628 4.86477 5.26498 10.1292 7.64585 numMergedOcc 0
13 mol 115 unq 5 iso 0 dist 6.12404 5.22628 5.24961 9.16391 13.8388 9.66954 numMergedOcc 0
14 mol 115 unq 6 iso 0 dist 6.12404 5.22628 5.24961 5.26498 5.58063 7.64585 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 5.59311 8.94909 14.4095 11.1266 15.7784 7.92688 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 9.22456 8.94909 17.145 11.1266 20.0402 7.92688 numMergedOcc 0
17 mol 133 unq 2 iso 0 dist 5.7232 8.94909 5.37072 11.1266 11.5756 7.92688 numMergedOcc 0
18 mol 152 unq 0 iso 0 dist 8.30966 9.0847 12.2051 12.6562 16.6439 9.13561 numMergedOcc 0
19 mol 173 unq 0 iso 0 dist 7.76856 9.09857 10.6484 9.00192 9.56248 8.31897 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 8.94464 9.50454 9.32503 10.9336 13.9657 6.93764 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 8.94464 7.15963 13.2985 9.09192 12.4394 6.94688 numMergedOcc 0
22 mol 181 unq 2 iso 0 dist 8.94464 7.15963 13.2985 12.1848 15.301 6.71012 numMergedOcc 0
23 mol 181 unq 3 iso 0 dist 8.63713 9.50454 8.88398 10.9336 13.5592 6.93764 numMergedOcc 0
24 mol 181 unq 4 iso 0 dist 8.63713 7.15963 4.98009 9.09192 9.20477 6.94688 numMergedOcc 0
25 mol 181 unq 5 iso 0 dist 8.63713 7.15963 4.98009 12.1848 7.90237 6.71012 numMergedOcc 0
26 mol 181 unq 6 iso 0 dist 5.08796 6.43406 4.3158 4.56814 6.17129 4.93785 numMergedOcc 0
27 mol 181 unq 7 iso 0 dist 5.93515 6.43406 4.3226 4.56814 5.83596 4.93785 numMergedOcc 0
28 mol 183 unq 0 iso 0 dist 8.53483 9.09322 7.79648 6.93732 7.42108 7.01383 numMergedOcc 0
29 mol 183 unq 1 iso 0 dist 8.50695 9.60723 6.50505 4.50779 9.19941 7.01383 numMergedOcc 0
30 mol 197 unq 0 iso 0 dist 8.61953 9.14737 10.5326 7.69844 8.32685 8.99696 numMergedOcc 0
31 mol 197 unq 1 iso 0 dist 8.61953 9.14737 10.5326 15.0242 18.309 7.85058 numMergedOcc 0
32 mol 197 unq 2 iso 0 dist 8.61953 9.14737 10.5326 12.1399 15.9649 9.96638 numMergedOcc 0
33 mol 197 unq 3 iso 0 dist 7.91999 9.14737 5.29309 7.69844 6.74777 8.99696 numMergedOcc 0
34 mol 197 unq 4 iso 0 dist 7.91999 9.14737 5.29309 15.0242 13.021 7.85058 numMergedOcc 0
35 mol 197 unq 5 iso 0 dist 7.91999 9.14737 5.29309 12.1399 12.0882 9.96638 numMergedOcc 0
36 mol 235 unq 0 iso 0 dist 8.38547 8.79626 10.504 12.9417 16.0053 7.32211 numMergedOcc 0
37 mol 236 unq 0 iso 0 dist 4.43243 5.99137 4.15973 4.47231 6.98151 5.34718 numMergedOcc 0
38 mol 236 unq 1 iso 0 dist 5.92025 5.99137 9.01197 4.47231 9.91572 5.34718 numMergedOcc 0
39 mol 236 unq 2 iso 0 dist 9.04819 5.99137 14.6016 4.47231 12.8714 5.34718 numMergedOcc 0
40 mol 238 unq 0 iso 0 dist 8.92585 6.51823 10.7712 9.28896 10.3764 6.77463 numMergedOcc 0
41 mol 238 unq 1 iso 0 dist 8.92585 6.51823 10.7712 6.04481 6.24435 7.2766 numMergedOcc 0
42 mol 259 unq 0 iso 0 dist 8.93002 6.20344 9.79538 12.9748 13.1236 7.48005 numMergedOcc 0
43 mol 259 unq 1 iso 0 dist 6.83706 8.69345 10.7398 13.2072 14.6202 7.50578 numMergedOcc 0
