0 mol 7 unq 0 iso 0 dist 8.8576 5.83293 6.8464 5.33843 5.99459 4.65291 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 7.0208 5.1956 5.36937 5.8449 8.84686 3.80208 numMergedOcc 0
2 mol 14 unq 1 iso 0 dist 7.28563 6.38279 5.36937 8.29358 8.84686 3.80208 numMergedOcc 0
3 mol 38 unq 0 iso 0 dist 9.70612 13.6797 9.30722 8.46463 9.19165 6.31143 numMergedOcc 0
4 mol 60 unq 0 iso 0 dist 8.46609 9.47661 7.15352 12.2249 7.57295 10.7546 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 7.63534 12.1289 8.77218 10.4541 9.85905 14.6511 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 8.51543 5.51994 7.46657 5.4968 6.72869 6.38237 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 8.83 7.74626 5.91259 6.09323 9.13322 4.2488 numMergedOcc 0
8 mol 110 unq 0 iso 0 dist 7.2461 4.06845 7.32156 4.10689 8.49678 5.2677 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 5.11612 5.73904 7.9258 3.85674 6.24825 6.27754 numMergedOcc 0
10 mol 122 unq 0 iso 0 dist 8.054 8.9579 8.75778 9.02961 6.00603 4.06619 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 6.47346 11.0685 8.59695 4.0844 5.58833 11.7456 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 6.47346 3.86284 6.42706 4.0844 5.58833 7.04681 numMergedOcc 0
13 mol 178 unq 0 iso 0 dist 7.14849 12.4035 9.63185 3.95924 9.11204 11.4463 numMergedOcc 0
14 mol 178 unq 1 iso 0 dist 8.63718 7.28647 9.63185 12.5927 9.11204 11.4463 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 6.20646 12.7269 9.44947 6.05253 7.9133 14.13 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 6.73266 7.03981 9.44947 13.3588 7.9133 14.13 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 5.99137 7.15062 7.87233 13.9834 9.3206 16.5242 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 6.97756 7.46206 7.73213 4.63415 7.95042 10.7255 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 9.64889 10.6345 4.81916 5.36788 9.35539 9.31926 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 9.64889 10.6345 4.81916 15.23 8.9682 13.1828 numMergedOcc 0
21 mol 277 unq 2 iso 0 dist 9.64889 10.6345 4.81916 15.0167 6.92711 10.6994 numMergedOcc 0
22 mol 280 unq 0 iso 0 dist 9.0021 7.41099 5.41639 9.81388 6.02353 4.06908 numMergedOcc 0
