0 mol 11 unq 0 iso 0 dist 9.91417 4.42747 5.56531 6.56346 8.01262 4.80143 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 8.66515 6.6309 9.06342 5.27699 7.42612 4.8899 numMergedOcc 0
2 mol 13 unq 1 iso 0 dist 9.48239 5.69416 9.06342 6.85341 7.42612 4.8899 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 7.52145 9.74984 5.78231 5.27705 8.91596 12.4304 numMergedOcc 0
4 mol 32 unq 1 iso 0 dist 7.52145 7.27475 9.41538 5.27705 8.91596 4.5514 numMergedOcc 0
5 mol 32 unq 2 iso 0 dist 8.35776 11.3409 5.78231 10.2135 8.91596 12.4304 numMergedOcc 0
6 mol 32 unq 3 iso 0 dist 8.35776 8.8719 9.41538 10.2135 8.91596 4.5514 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 7.12713 8.08636 5.81662 13.6849 9.45756 5.80658 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 5.61831 4.63832 8.63792 5.66392 7.61521 8.18176 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 7.61514 5.40682 6.56288 12.3909 7.69926 7.72238 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 8.21116 5.40682 5.97559 12.3909 5.85237 7.72238 numMergedOcc 0
11 mol 85 unq 2 iso 0 dist 8.21116 5.40682 5.97559 17.1393 9.11768 14.2934 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 4.30961 5.67628 8.71568 7.12509 7.44558 10.6579 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 4.30961 4.86796 5.81859 7.12509 7.44558 6.24368 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 4.60192 5.16802 8.03867 7.23362 7.42146 10.6596 numMergedOcc 0
15 mol 117 unq 1 iso 0 dist 4.60192 4.87865 5.94465 7.23362 7.42146 6.3368 numMergedOcc 0
16 mol 120 unq 0 iso 0 dist 8.31527 10.7979 5.56598 8.90504 7.53694 5.6257 numMergedOcc 0
17 mol 120 unq 1 iso 0 dist 8.31527 6.76794 5.39792 8.90504 7.53694 5.0256 numMergedOcc 0
18 mol 120 unq 2 iso 0 dist 8.31527 5.49859 7.00542 8.90504 7.53694 8.66137 numMergedOcc 0
19 mol 120 unq 3 iso 0 dist 7.64841 6.76794 8.44206 8.90504 8.38358 5.0256 numMergedOcc 0
20 mol 120 unq 4 iso 0 dist 7.64841 5.49859 9.78884 8.90504 8.38358 8.66137 numMergedOcc 0
21 mol 154 unq 0 iso 0 dist 5.55632 4.57254 8.50487 10.0762 8.89394 8.81984 numMergedOcc 0
22 mol 167 unq 0 iso 0 dist 8.88037 3.85333 8.0697 7.79718 5.36671 9.37794 numMergedOcc 0
23 mol 194 unq 0 iso 0 dist 9.3032 10.4172 4.55528 5.69334 9.52922 9.45062 numMergedOcc 0
24 mol 194 unq 1 iso 0 dist 9.3032 13.6082 6.88386 5.69334 9.52922 10.6236 numMergedOcc 0
25 mol 194 unq 2 iso 0 dist 8.10451 10.3249 4.55528 13.5654 9.52922 9.45062 numMergedOcc 0
26 mol 194 unq 3 iso 0 dist 8.10451 6.55814 6.88386 13.5654 9.52922 10.6236 numMergedOcc 0
27 mol 194 unq 4 iso 0 dist 6.6747 10.3249 4.42095 11.1132 9.38984 10.8182 numMergedOcc 0
28 mol 194 unq 5 iso 0 dist 6.6747 10.3249 4.42095 14.0553 9.91118 10.0354 numMergedOcc 0
29 mol 194 unq 6 iso 0 dist 6.6747 6.55814 4.63898 11.1132 9.38984 7.58286 numMergedOcc 0
30 mol 194 unq 7 iso 0 dist 6.6747 6.55814 4.63898 14.0553 9.91118 9.53373 numMergedOcc 0
31 mol 194 unq 8 iso 0 dist 6.6747 14.9692 9.53641 11.1132 9.38984 10.4127 numMergedOcc 0
32 mol 194 unq 9 iso 0 dist 6.6747 14.9692 9.53641 14.0553 9.91118 7.1015 numMergedOcc 0
33 mol 194 unq 10 iso 0 dist 6.28412 6.65382 4.42095 7.69242 9.38984 10.8182 numMergedOcc 0
34 mol 194 unq 11 iso 0 dist 6.28412 6.65382 4.42095 5.16091 9.91118 10.0354 numMergedOcc 0
35 mol 194 unq 12 iso 0 dist 6.28412 8.25387 4.63898 7.69242 9.38984 7.58286 numMergedOcc 0
36 mol 194 unq 13 iso 0 dist 6.28412 8.25387 4.63898 5.16091 9.91118 9.53373 numMergedOcc 0
37 mol 194 unq 14 iso 0 dist 6.28412 4.09071 9.53641 7.69242 9.38984 10.4127 numMergedOcc 0
38 mol 194 unq 15 iso 0 dist 6.28412 4.09071 9.53641 5.16091 9.91118 7.1015 numMergedOcc 0
39 mol 225 unq 0 iso 0 dist 7.22151 4.40718 5.65735 5.78711 8.40074 4.41663 numMergedOcc 0
40 mol 252 unq 0 iso 0 dist 4.15692 4.87406 5.2116 7.00892 8.55044 4.52914 numMergedOcc 0
41 mol 253 unq 0 iso 0 dist 8.34984 5.52102 8.58013 5.34337 9.19385 7.40932 numMergedOcc 0
42 mol 253 unq 1 iso 0 dist 8.34984 5.52102 8.58013 11.9048 9.1927 10.9466 numMergedOcc 0
43 mol 266 unq 0 iso 0 dist 9.20906 6.79927 7.43884 8.34545 9.29666 9.65978 numMergedOcc 0
44 mol 266 unq 1 iso 0 dist 9.03099 12.1152 7.43884 18.0944 9.29666 9.65978 numMergedOcc 0
45 mol 281 unq 0 iso 0 dist 8.78416 4.88562 9.05453 6.83107 5.50053 4.89583 numMergedOcc 0
46 mol 281 unq 1 iso 0 dist 7.82358 5.91239 9.05453 5.22248 5.50053 4.89583 numMergedOcc 0
