0 mol 12 unq 0 iso 0 dist 6.13335 4.46781 9.41745 10.2163 7.4036 10.9547 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 8.2298 10.4593 8.48453 9.71915 7.02884 4.03817 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 8.2298 6.57611 8.80499 9.71915 7.02884 5.12703 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 7.98958 5.2549 9.15677 10.7527 9.53735 10.797 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 9.57343 11.6128 9.31319 13.4254 6.19084 10.5906 numMergedOcc 0
5 mol 46 unq 1 iso 0 dist 9.57343 6.124 8.2513 13.4254 6.19084 12.8683 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 9.56015 11.935 9.84668 9.23385 7.35929 7.78153 numMergedOcc 0
7 mol 66 unq 0 iso 0 dist 7.59498 11.9477 8.04639 6.84496 5.75397 5.99928 numMergedOcc 0
8 mol 66 unq 1 iso 0 dist 7.59498 11.9477 8.04639 10.9779 9.11975 4.38694 numMergedOcc 0
9 mol 66 unq 2 iso 0 dist 7.59498 9.87898 7.69019 6.84496 5.75397 5.61937 numMergedOcc 0
10 mol 66 unq 3 iso 0 dist 7.59498 9.87898 7.69019 10.9779 9.11975 7.22146 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 7.33878 11.9395 9.7168 6.09869 9.92375 11.2659 numMergedOcc 0
12 mol 148 unq 1 iso 0 dist 7.33878 8.04205 7.38138 6.09869 9.92375 4.99768 numMergedOcc 0
13 mol 158 unq 0 iso 0 dist 9.66949 4.78033 8.1504 5.37594 9.58371 7.49843 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 8.24466 8.03208 6.60651 9.71153 6.67699 8.50224 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 9.71689 10.1816 7.92766 11.9752 6.21588 5.86489 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 9.71689 7.7596 6.32652 11.9752 6.21588 11.2903 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 8.74491 7.15202 9.40939 5.6651 8.53661 8.47474 numMergedOcc 0
18 mol 213 unq 1 iso 0 dist 8.74491 11.621 9.06306 5.6651 8.53661 15.1193 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 8.61758 4.7088 8.3035 11.1989 8.07237 7.8472 numMergedOcc 0
20 mol 250 unq 0 iso 0 dist 8.06649 6.15778 6.18342 14.3949 9.5174 10.8792 numMergedOcc 0
21 mol 253 unq 0 iso 0 dist 5.85222 12.3321 7.0247 11.6772 8.70383 5.78064 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 6.2587 9.05051 9.22576 7.53523 9.52718 4.9628 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 6.2587 9.05051 9.22576 7.53523 9.52718 4.9628 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 6.2587 9.05051 9.22576 7.53523 9.52718 4.9628 numMergedOcc 0
