0 mol 17 unq 0 iso 0 dist 8.35273 7.95079 7.324 5.5951 4.64234 5.34782 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.35273 4.79124 7.18716 5.5951 4.64234 6.74307 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 5.23167 6.37499 6.51901 8.02816 7.25138 10.1564 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 5.23167 11.7209 9.1926 8.02816 7.25138 10.5761 numMergedOcc 0
4 mol 62 unq 2 iso 0 dist 7.47607 9.79569 6.51901 5.07643 7.25138 10.1564 numMergedOcc 0
5 mol 62 unq 3 iso 0 dist 7.47607 13.1832 9.1926 5.07643 7.25138 10.5761 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.45955 5.1569 9.50763 4.76152 7.94132 5.65538 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 5.61831 4.63832 8.63792 5.94401 6.46582 4.35001 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 9.98861 8.14775 6.02596 4.93451 6.10053 4.14427 numMergedOcc 0
9 mol 90 unq 1 iso 0 dist 9.98861 14.9764 8.17454 4.93451 6.10053 10.1669 numMergedOcc 0
10 mol 90 unq 2 iso 0 dist 5.52904 4.03085 6.02596 5.41685 6.10053 4.14427 numMergedOcc 0
11 mol 90 unq 3 iso 0 dist 5.52904 4.99029 8.17454 5.41685 6.10053 10.1669 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 4.30961 5.67628 8.71568 4.3613 6.3323 4.28681 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 4.30961 4.86796 5.81859 4.3613 6.3323 8.86634 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 6.38269 13.5639 9.44 12.0115 7.96893 15.0126 numMergedOcc 0
15 mol 117 unq 0 iso 0 dist 4.60192 5.16802 8.03867 4.36058 6.01857 4.01262 numMergedOcc 0
16 mol 117 unq 1 iso 0 dist 4.60192 4.87865 5.94465 4.36058 6.01857 8.64874 numMergedOcc 0
17 mol 120 unq 0 iso 0 dist 7.64841 6.76794 8.44206 9.0362 8.03124 10.1556 numMergedOcc 0
18 mol 120 unq 1 iso 0 dist 7.64841 5.49859 9.78884 9.0362 8.03124 12.3435 numMergedOcc 0
19 mol 129 unq 0 iso 0 dist 9.91021 8.63314 8.42277 4.452 7.93106 8.62597 numMergedOcc 0
20 mol 129 unq 1 iso 0 dist 9.91021 8.63314 8.42277 11.0787 7.04904 4.04119 numMergedOcc 0
21 mol 129 unq 2 iso 0 dist 5.5917 4.81238 8.42277 5.47042 7.93106 8.62597 numMergedOcc 0
22 mol 129 unq 3 iso 0 dist 5.5917 4.81238 8.42277 4.02665 7.04904 4.04119 numMergedOcc 0
23 mol 129 unq 4 iso 0 dist 5.24806 4.81238 6.26653 5.47042 9.05575 8.62597 numMergedOcc 0
24 mol 129 unq 5 iso 0 dist 5.24806 4.81238 6.26653 4.02665 5.06053 4.04119 numMergedOcc 0
25 mol 154 unq 0 iso 0 dist 5.55632 4.57254 8.50487 7.0408 8.26128 4.05045 numMergedOcc 0
26 mol 167 unq 0 iso 0 dist 8.88037 3.85333 8.0697 10.6672 8.95296 11.9696 numMergedOcc 0
27 mol 167 unq 1 iso 0 dist 8.88037 3.85333 8.0697 4.74884 6.10021 5.37536 numMergedOcc 0
28 mol 185 unq 0 iso 0 dist 9.62449 4.03855 8.60009 12.1385 8.07469 11.8032 numMergedOcc 0
29 mol 220 unq 0 iso 0 dist 7.39043 4.61842 6.23243 6.24332 7.45831 4.12315 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 9.76929 7.66679 7.45508 3.39532 8.53092 9.19611 numMergedOcc 0
31 mol 253 unq 0 iso 0 dist 8.34984 5.52102 8.58013 7.48068 8.71119 6.34554 numMergedOcc 0
32 mol 281 unq 0 iso 0 dist 8.78416 4.88562 9.05453 6.85714 6.82918 9.92739 numMergedOcc 0
33 mol 281 unq 1 iso 0 dist 7.82358 5.91239 9.05453 12.3603 6.82918 9.92739 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 7.96707 13.5162 9.03468 9.99556 8.71974 6.1412 numMergedOcc 0
35 mol 287 unq 1 iso 0 dist 7.96707 13.5162 9.03468 7.99722 8.82649 13.2279 numMergedOcc 0
36 mol 287 unq 2 iso 0 dist 7.96707 13.5162 9.03468 12.9629 7.35776 12.5251 numMergedOcc 0
37 mol 287 unq 3 iso 0 dist 7.96707 5.22713 6.05363 9.99556 8.71974 11.8278 numMergedOcc 0
38 mol 287 unq 4 iso 0 dist 7.96707 5.22713 6.05363 7.99722 8.82649 4.22529 numMergedOcc 0
39 mol 287 unq 5 iso 0 dist 7.96707 5.22713 6.05363 12.9629 7.35776 8.19487 numMergedOcc 0
40 mol 288 unq 0 iso 0 dist 7.96707 13.5162 9.03468 9.99556 8.71974 6.1412 numMergedOcc 0
41 mol 288 unq 1 iso 0 dist 7.96707 13.5162 9.03468 7.99722 8.82649 13.2279 numMergedOcc 0
42 mol 288 unq 2 iso 0 dist 7.96707 13.5162 9.03468 12.9629 7.35776 12.5251 numMergedOcc 0
43 mol 288 unq 3 iso 0 dist 7.96707 5.22713 6.05363 9.99556 8.71974 11.8278 numMergedOcc 0
44 mol 288 unq 4 iso 0 dist 7.96707 5.22713 6.05363 7.99722 8.82649 4.22529 numMergedOcc 0
45 mol 288 unq 5 iso 0 dist 7.96707 5.22713 6.05363 12.9629 7.35776 8.19487 numMergedOcc 0
46 mol 289 unq 0 iso 0 dist 7.96707 13.5162 9.03468 9.99556 8.71974 6.1412 numMergedOcc 0
47 mol 289 unq 1 iso 0 dist 7.96707 13.5162 9.03468 7.99722 8.82649 13.2279 numMergedOcc 0
48 mol 289 unq 2 iso 0 dist 7.96707 13.5162 9.03468 12.9629 7.35776 12.5251 numMergedOcc 0
49 mol 289 unq 3 iso 0 dist 7.96707 5.22713 6.05363 9.99556 8.71974 11.8278 numMergedOcc 0
50 mol 289 unq 4 iso 0 dist 7.96707 5.22713 6.05363 7.99722 8.82649 4.22529 numMergedOcc 0
51 mol 289 unq 5 iso 0 dist 7.96707 5.22713 6.05363 12.9629 7.35776 8.19487 numMergedOcc 0
52 mol 294 unq 0 iso 0 dist 6.82335 11.0879 8.81999 5.90162 9.64969 8.9836 numMergedOcc 0
53 mol 294 unq 1 iso 0 dist 9.14005 14.7951 8.81999 8.68297 9.64969 8.9836 numMergedOcc 0
