0 mol 0 unq 0 iso 0 dist 7.37981 7.30381 5.24778 8.2542 11.8368 9.00092 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 7.97656 9.57675 4.56335 14.2026 11.9082 7.53416 numMergedOcc 0
2 mol 60 unq 0 iso 0 dist 8.82095 9.34193 9.49968 7.32774 7.57295 6.63448 numMergedOcc 0
3 mol 60 unq 1 iso 0 dist 6.27749 9.34193 5.32257 7.32774 7.48086 6.63448 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 6.85381 9.69961 5.39346 11.4567 10.2348 8.72725 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 6.85381 9.69961 5.39346 11.4288 9.95699 6.11407 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 8.53368 5.58734 6.36778 6.14609 9.77575 6.18678 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 9.61081 5.75595 10.0059 7.51335 10.9972 5.06564 numMergedOcc 0
8 mol 143 unq 1 iso 0 dist 5.46922 5.75595 8.57817 7.51335 10.7327 5.06564 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 8.69888 9.27911 15.6247 9.20141 13.9493 8.81244 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 6.43406 6.66608 5.48529 5.71744 5.05973 5.99437 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 6.43406 6.66608 5.48529 6.42494 8.40951 8.4848 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 7.86625 9.68323 7.68794 9.16709 13.5224 8.62102 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 9.72979 6.69623 11.7977 4.25315 13.9709 8.24419 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 6.97859 6.69623 10.4747 4.25315 10.2649 8.24419 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 8.39425 9.4707 4.82315 5.11711 9.58404 8.24649 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 9.75313 6.48885 10.7174 3.56689 8.08349 5.05368 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 9.18675 8.61546 10.8138 17.592 17.5418 9.18728 numMergedOcc 0
18 mol 232 unq 0 iso 0 dist 8.68464 6.23146 11.776 11.433 15.6923 6.59036 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 7.80446 8.30714 13.0115 12.0951 14.6935 7.77765 numMergedOcc 0
20 mol 274 unq 1 iso 0 dist 7.80446 8.30714 13.0115 16.7767 22.6006 9.65868 numMergedOcc 0
21 mol 274 unq 2 iso 0 dist 9.86142 8.30714 11.5044 12.0951 11.2637 7.77765 numMergedOcc 0
22 mol 274 unq 3 iso 0 dist 9.86142 8.30714 11.5044 16.7767 20.9738 9.65868 numMergedOcc 0
23 mol 274 unq 4 iso 0 dist 8.66451 9.02661 6.70925 4.89003 6.4611 8.60027 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 8.57532 5.92532 6.82888 13.3706 14.9195 9.26157 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 9.02914 5.92532 4.37645 13.3706 5.46926 9.26157 numMergedOcc 0
26 mol 277 unq 2 iso 0 dist 6.90434 5.92532 7.70529 13.3706 8.9682 9.26157 numMergedOcc 0
27 mol 278 unq 0 iso 0 dist 9.82774 8.20933 14.3412 8.04035 15.2028 9.03998 numMergedOcc 0
