0 mol 63 unq 0 iso 0 dist 8.74231 8.11469 9.84668 7.04642 6.65465 11.8129 numMergedOcc 0
1 mol 63 unq 1 iso 0 dist 8.52783 11.1873 9.84668 5.0104 6.65465 11.8129 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 9.60879 5.29324 6.27528 4.37571 9.37524 7.65009 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 9.61096 6.25645 6.27528 7.64952 9.37524 7.65009 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 7.24378 13.8345 8.28737 12.5599 7.63534 6.77871 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 8.40871 15.2043 7.80757 14.0613 9.45835 5.53214 numMergedOcc 0
6 mol 78 unq 1 iso 0 dist 8.40871 6.23394 9.2835 14.0613 9.45835 14.7492 numMergedOcc 0
7 mol 78 unq 2 iso 0 dist 8.40871 7.51473 5.02591 14.0613 9.45835 10.6915 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 9.03233 6.47184 6.7319 5.79542 7.39851 6.48668 numMergedOcc 0
9 mol 196 unq 0 iso 0 dist 9.29791 7.39393 6.60651 7.41182 7.84536 10.2953 numMergedOcc 0
10 mol 196 unq 1 iso 0 dist 9.29791 7.39393 6.60651 8.83138 7.07723 11.554 numMergedOcc 0
11 mol 196 unq 2 iso 0 dist 9.29791 7.39393 6.60651 5.13432 6.40064 6.29554 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 9.65951 9.46843 7.92766 6.43379 6.20646 10.7365 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 9.65951 9.46843 7.92766 15.1056 6.73266 14.1382 numMergedOcc 0
14 mol 204 unq 2 iso 0 dist 9.14829 14.3686 7.92766 4.88222 6.20646 10.7365 numMergedOcc 0
15 mol 204 unq 3 iso 0 dist 9.14829 14.3686 7.92766 11.2409 6.73266 14.1382 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 6.9028 14.2022 7.96424 9.44535 6.93717 10.5016 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 7.23901 13.7941 7.96424 4.96764 6.93717 10.5016 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 6.82584 5.45929 8.92185 5.05913 9.88432 8.0584 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.94587 13.6648 9.82174 6.11661 8.39522 8.0362 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 9.09166 12.3198 9.2521 4.90492 5.99187 8.0362 numMergedOcc 0
21 mol 253 unq 0 iso 0 dist 9.75753 15.0104 5.76077 9.62028 9.86979 12.8509 numMergedOcc 0
22 mol 253 unq 1 iso 0 dist 9.75753 10.5007 7.0247 9.62028 9.86979 11.3218 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 9.60619 17.3271 8.27977 8.0951 7.63115 11.9125 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 7.29148 4.70797 6.8133 12.4879 8.99442 10.1792 numMergedOcc 0
