0 mol 24 unq 0 iso 0 dist 4.78749 8.48944 13.2768 10.0482 14.3641 5.22014 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.3613 5.39587 9.0284 9.05146 11.8967 5.51172 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 6.68599 4.29713 6.02913 10.1173 11.7401 6.64721 numMergedOcc 0
3 mol 41 unq 1 iso 0 dist 6.68599 4.29713 6.02913 11.2861 11.9438 9.36169 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 7.65981 6.68114 8.3816 7.7602 12.8503 5.69981 numMergedOcc 0
5 mol 55 unq 1 iso 0 dist 7.65981 6.68114 8.3816 7.71738 10.0388 9.873 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 9.16791 7.21134 10.1031 4.9038 13.999 9.77648 numMergedOcc 0
7 mol 69 unq 1 iso 0 dist 9.16791 7.21134 10.1031 14.266 18.9282 9.18161 numMergedOcc 0
8 mol 69 unq 2 iso 0 dist 6.57452 7.21134 9.81292 4.9038 8.72237 9.77648 numMergedOcc 0
9 mol 69 unq 3 iso 0 dist 6.57452 7.21134 9.81292 14.266 16.91 9.18161 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 9.26306 9.08834 4.41928 4.31415 7.6981 8.37559 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 6.88956 5.62245 6.86277 5.07478 10.6107 6.6142 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 7.60412 8.59103 4.57343 5.22066 8.00416 5.93561 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 7.11102 8.54304 11.5247 12.511 14.548 9.26505 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 6.58174 7.59666 5.9546 4.65143 10.3564 9.04035 numMergedOcc 0
15 mol 204 unq 1 iso 0 dist 6.58174 7.59666 5.9546 7.02985 8.73423 8.73525 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 9.10154 8.1692 5.59992 9.48135 11.7466 8.22129 numMergedOcc 0
17 mol 243 unq 0 iso 0 dist 7.72368 9.89379 7.33221 4.72507 8.02005 8.92798 numMergedOcc 0
18 mol 260 unq 0 iso 0 dist 7.95918 8.19223 7.37194 5.49565 11.2778 7.1699 numMergedOcc 0
