0 mol 18 unq 0 iso 0 dist 9.4649 8.1366 16.059 6.91413 15.2258 9.146 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.45965 8.1366 12.619 6.91413 5.9929 9.146 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.12062 6.20159 10.4051 8.8717 14.7325 4.77186 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 9.2794 9.54062 10.838 4.67358 10.1805 5.93023 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.32868 7.69672 5.71215 7.05954 6.3035 7.43726 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 9.00111 9.39787 13.5465 8.39026 3.95956 14.3419 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 9.71025 5.7306 10.3934 6.03116 11.9291 3.44683 numMergedOcc 0
7 mol 167 unq 0 iso 0 dist 9.08229 7.71402 11.7541 6.6276 6.2621 8.73305 numMergedOcc 0
8 mol 167 unq 1 iso 0 dist 9.08229 4.74768 7.86284 6.6276 6.2621 5.07469 numMergedOcc 0
9 mol 167 unq 2 iso 0 dist 7.99057 7.71402 13.2159 6.6276 6.17537 8.73305 numMergedOcc 0
10 mol 167 unq 3 iso 0 dist 7.99057 4.74768 3.81048 6.6276 6.17537 5.07469 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 8.51112 8.77346 8.93396 8.22643 6.90444 12.7228 numMergedOcc 0
12 mol 206 unq 0 iso 0 dist 8.90607 6.28518 8.46949 7.47477 8.679 9.9437 numMergedOcc 0
13 mol 240 unq 0 iso 0 dist 9.23116 7.43296 6.5325 5.46783 6.95406 9.42043 numMergedOcc 0
14 mol 240 unq 1 iso 0 dist 5.76042 7.43296 4.6158 5.46783 10.178 9.42043 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 9.45685 9.95473 4.41915 8.43941 6.73942 3.42387 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 7.90537 6.57555 4.40935 8.2776 8.0809 4.933 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 8.07113 9.00616 12.3982 5.67349 3.67304 9.46424 numMergedOcc 0
18 mol 261 unq 1 iso 0 dist 8.07113 6.35699 9.84177 5.67349 3.67304 7.48263 numMergedOcc 0
