0 mol 7 unq 0 iso 0 dist 7.32392 10.5949 6.7985 11.5036 5.38502 8.02892 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 8.4361 5.06195 6.62144 9.44528 6.25083 6.0266 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.96238 4.936 7.16773 12.7012 7.91078 9.78973 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 5.90776 5.47738 5.37007 4.85152 6.82886 7.2131 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 5.85841 4.81103 5.78706 8.87856 6.83826 4.94406 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 5.85841 4.81103 5.78706 6.2491 9.30656 7.2337 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 6.78839 7.22196 5.78706 11.3126 6.83826 4.94406 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 6.78839 7.22196 5.78706 3.59451 9.30656 7.2337 numMergedOcc 0
8 mol 98 unq 4 iso 0 dist 7.00285 4.81103 5.59328 8.87856 9.94628 4.94406 numMergedOcc 0
9 mol 98 unq 5 iso 0 dist 7.00285 4.81103 5.59328 6.2491 5.39087 7.2337 numMergedOcc 0
10 mol 98 unq 6 iso 0 dist 8.02354 7.22196 5.59328 11.3126 9.94628 4.94406 numMergedOcc 0
11 mol 98 unq 7 iso 0 dist 8.02354 7.22196 5.59328 3.59451 5.39087 7.2337 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 8.22596 6.21679 7.80975 14.4372 12.3004 9.1593 numMergedOcc 0
13 mol 125 unq 0 iso 0 dist 6.03557 8.27647 9.3778 9.64304 9.19339 9.2657 numMergedOcc 0
14 mol 125 unq 1 iso 0 dist 7.76202 7.74181 7.47069 6.6081 6.92879 9.2657 numMergedOcc 0
15 mol 129 unq 0 iso 0 dist 6.23966 6.47522 6.28565 15.9394 12.2044 9.86237 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 9.47675 9.00056 9.97343 8.51265 10.4653 8.35864 numMergedOcc 0
17 mol 156 unq 0 iso 0 dist 9.19499 5.02458 9.44367 6.67598 5.0966 9.6281 numMergedOcc 0
18 mol 156 unq 1 iso 0 dist 9.19499 5.02458 9.44367 8.79185 9.07974 6.22667 numMergedOcc 0
19 mol 156 unq 2 iso 0 dist 9.19499 15.8724 9.47433 20.3058 11.8579 7.70894 numMergedOcc 0
20 mol 156 unq 3 iso 0 dist 7.11647 5.02458 7.90267 6.67598 5.75141 9.6281 numMergedOcc 0
21 mol 156 unq 4 iso 0 dist 7.11647 5.02458 7.90267 8.79185 5.70205 6.22667 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 6.15806 5.07333 5.44002 10.4566 6.4623 6.05667 numMergedOcc 0
23 mol 232 unq 0 iso 0 dist 9.95045 4.95971 9.05071 10.7924 13.6402 6.23146 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 9.38753 6.77421 7.10685 13.7782 5.0871 9.43474 numMergedOcc 0
25 mol 274 unq 0 iso 0 dist 5.82876 4.48276 7.46394 8.17922 7.97998 8.30714 numMergedOcc 0
26 mol 274 unq 1 iso 0 dist 8.71129 4.48276 7.1729 8.17922 5.7745 8.30714 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 5.70546 4.99186 7.23721 8.76889 9.36068 8.16582 numMergedOcc 0
