0 mol 32 unq 0 iso 0 dist 7.52145 9.74984 5.78231 5.26423 6.89423 6.39966 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 7.52145 7.27475 9.41538 5.26423 6.89423 10.5977 numMergedOcc 0
2 mol 32 unq 2 iso 0 dist 8.35776 11.3409 5.78231 14.188 6.89423 6.39966 numMergedOcc 0
3 mol 32 unq 3 iso 0 dist 8.35776 8.8719 9.41538 14.188 6.89423 10.5977 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 7.12713 8.08636 5.81662 8.18746 8.99393 6.92267 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 9.80453 12.4087 9.07283 4.38483 7.32699 11.6226 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 9.80453 12.4087 9.07283 8.2379 6.45933 6.87877 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 6.45955 5.1569 9.50763 7.49788 7.75075 5.30015 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 4.30961 5.67628 8.71568 5.24487 7.68838 8.39835 numMergedOcc 0
9 mol 109 unq 1 iso 0 dist 4.30961 4.86796 5.81859 5.24487 7.68838 6.60434 numMergedOcc 0
10 mol 117 unq 0 iso 0 dist 4.60192 5.16802 8.03867 5.4348 8.16392 8.1844 numMergedOcc 0
11 mol 117 unq 1 iso 0 dist 4.60192 4.87865 5.94465 5.4348 8.16392 6.63536 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.89804 7.35256 8.78251 11.8656 7.62945 14.813 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 9.3032 10.4172 4.55528 14.008 7.26295 7.59741 numMergedOcc 0
14 mol 194 unq 1 iso 0 dist 9.3032 13.6082 6.88386 14.008 7.26295 11.577 numMergedOcc 0
15 mol 194 unq 2 iso 0 dist 8.10451 10.3249 4.55528 13.2027 7.26295 7.59741 numMergedOcc 0
16 mol 194 unq 3 iso 0 dist 8.10451 6.55814 6.88386 13.2027 7.26295 11.577 numMergedOcc 0
17 mol 194 unq 4 iso 0 dist 6.6747 10.3249 4.42095 13.2027 7.31316 7.59741 numMergedOcc 0
18 mol 194 unq 5 iso 0 dist 6.6747 10.3249 4.42095 4.71471 8.9865 12.4055 numMergedOcc 0
19 mol 194 unq 6 iso 0 dist 6.6747 6.55814 4.63898 13.2027 7.31316 11.577 numMergedOcc 0
20 mol 194 unq 7 iso 0 dist 6.6747 6.55814 4.63898 4.71471 8.9865 7.3101 numMergedOcc 0
21 mol 194 unq 8 iso 0 dist 6.6747 14.9692 9.53641 13.2027 7.31316 7.22039 numMergedOcc 0
22 mol 194 unq 9 iso 0 dist 6.6747 14.9692 9.53641 4.71471 8.9865 15.217 numMergedOcc 0
23 mol 194 unq 10 iso 0 dist 6.28412 6.65382 4.42095 7.02856 7.31316 7.59741 numMergedOcc 0
24 mol 194 unq 11 iso 0 dist 6.28412 6.65382 4.42095 12.3079 8.9865 12.4055 numMergedOcc 0
25 mol 194 unq 12 iso 0 dist 6.28412 8.25387 4.63898 7.02856 7.31316 11.577 numMergedOcc 0
26 mol 194 unq 13 iso 0 dist 6.28412 8.25387 4.63898 12.3079 8.9865 7.3101 numMergedOcc 0
27 mol 194 unq 14 iso 0 dist 6.28412 4.09071 9.53641 7.02856 7.31316 7.22039 numMergedOcc 0
28 mol 194 unq 15 iso 0 dist 6.28412 4.09071 9.53641 12.3079 8.9865 15.217 numMergedOcc 0
29 mol 239 unq 0 iso 0 dist 9.76929 7.66679 7.45508 6.01923 7.14918 4.30527 numMergedOcc 0
30 mol 243 unq 0 iso 0 dist 8.35328 5.23854 7.39884 5.52989 7.6142 6.58738 numMergedOcc 0
31 mol 252 unq 0 iso 0 dist 4.15692 4.87406 5.2116 5.5062 7.38867 9.93257 numMergedOcc 0
32 mol 281 unq 0 iso 0 dist 6.22003 10.9156 9.34464 13.6548 9.49871 5.39628 numMergedOcc 0
33 mol 287 unq 0 iso 0 dist 7.96707 13.5162 9.03468 16.9066 9.2144 13.1162 numMergedOcc 0
34 mol 287 unq 1 iso 0 dist 7.96707 5.22713 6.05363 16.9066 9.2144 13.3584 numMergedOcc 0
35 mol 288 unq 0 iso 0 dist 7.96707 13.5162 9.03468 16.9066 9.2144 13.1162 numMergedOcc 0
36 mol 288 unq 1 iso 0 dist 7.96707 5.22713 6.05363 16.9066 9.2144 13.3584 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 7.96707 13.5162 9.03468 16.9066 9.2144 13.1162 numMergedOcc 0
38 mol 289 unq 1 iso 0 dist 7.96707 5.22713 6.05363 16.9066 9.2144 13.3584 numMergedOcc 0
