0 mol 37 unq 0 iso 0 dist 7.47638 9.15499 6.28359 4.87451 6.84257 11.4295 numMergedOcc 0
1 mol 37 unq 1 iso 0 dist 7.47638 9.15499 6.28359 12.8406 9.21102 14.8933 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 9.30086 7.33624 11.846 7.50884 9.52298 13.5546 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.52142 8.8014 11.1122 4.3044 5.48997 7.50377 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 7.55581 7.33743 7.15161 6.14253 5.92836 10.3522 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 7.55581 7.33743 7.15161 4.88407 4.73804 8.88752 numMergedOcc 0
6 mol 173 unq 0 iso 0 dist 5.15834 5.82174 6.97027 6.2739 8.44321 10.3813 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 8.99149 9.19831 10.3569 16.8109 9.58817 15.2535 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 8.45309 9.55112 10.5381 4.62365 8.49577 12.7641 numMergedOcc 0
9 mol 184 unq 1 iso 0 dist 8.45309 8.0343 7.10924 4.62365 8.49577 10.6384 numMergedOcc 0
10 mol 222 unq 0 iso 0 dist 8.37114 8.79662 5.13817 8.84473 5.17916 6.71817 numMergedOcc 0
11 mol 222 unq 1 iso 0 dist 8.37114 6.6497 4.54609 8.84473 5.17916 8.41524 numMergedOcc 0
12 mol 241 unq 0 iso 0 dist 4.66398 6.2767 5.65355 10.4606 8.00841 13.3137 numMergedOcc 0
13 mol 243 unq 0 iso 0 dist 6.41279 9.49016 13.4828 8.81017 7.2154 17.2187 numMergedOcc 0
14 mol 243 unq 1 iso 0 dist 6.41279 8.92798 11.2928 8.81017 7.2154 16.9637 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 5.15432 8.88095 11.0004 9.70626 8.51994 18.2446 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 8.85872 9.98518 9.11127 9.44841 7.58907 13.5766 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 8.01428 7.51385 4.53492 14.4188 9.30394 12.639 numMergedOcc 0
18 mol 287 unq 2 iso 0 dist 8.01428 7.51385 4.53492 10.5276 8.5458 8.43856 numMergedOcc 0
19 mol 287 unq 3 iso 0 dist 8.01428 7.51385 4.53492 8.40959 8.47385 5.83857 numMergedOcc 0
20 mol 287 unq 4 iso 0 dist 8.01428 7.51385 4.53492 6.45653 8.44356 5.32839 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 8.85872 9.98518 9.11127 9.44841 7.58907 13.5766 numMergedOcc 0
22 mol 288 unq 1 iso 0 dist 8.01428 7.51385 4.53492 14.4188 9.30394 12.639 numMergedOcc 0
23 mol 288 unq 2 iso 0 dist 8.01428 7.51385 4.53492 10.5276 8.5458 8.43856 numMergedOcc 0
24 mol 288 unq 3 iso 0 dist 8.01428 7.51385 4.53492 8.40959 8.47385 5.83857 numMergedOcc 0
25 mol 288 unq 4 iso 0 dist 8.01428 7.51385 4.53492 6.45653 8.44356 5.32839 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 8.85872 9.98518 9.11127 9.44841 7.58907 13.5766 numMergedOcc 0
27 mol 289 unq 1 iso 0 dist 8.01428 7.51385 4.53492 14.4188 9.30394 12.639 numMergedOcc 0
28 mol 289 unq 2 iso 0 dist 8.01428 7.51385 4.53492 10.5276 8.5458 8.43856 numMergedOcc 0
29 mol 289 unq 3 iso 0 dist 8.01428 7.51385 4.53492 8.40959 8.47385 5.83857 numMergedOcc 0
30 mol 289 unq 4 iso 0 dist 8.01428 7.51385 4.53492 6.45653 8.44356 5.32839 numMergedOcc 0
