0 mol 91 unq 0 iso 0 dist 5.78962 9.00799 7.15588 7.45168 11.3129 9.32713 numMergedOcc 0
1 mol 115 unq 0 iso 0 dist 9.95726 9.20544 13.1021 5.80806 11.9027 9.79579 numMergedOcc 0
2 mol 120 unq 0 iso 0 dist 9.66753 5.85006 9.42691 8.33981 14.1235 8.48405 numMergedOcc 0
3 mol 148 unq 0 iso 0 dist 9.71692 8.21863 7.81081 6.16168 11.144 8.60089 numMergedOcc 0
4 mol 150 unq 0 iso 0 dist 9.73708 8.16324 7.57411 6.14967 11.1402 8.54995 numMergedOcc 0
5 mol 162 unq 0 iso 0 dist 8.954 9.98649 10.8238 8.08223 14.5486 7.76954 numMergedOcc 0
6 mol 173 unq 0 iso 0 dist 5.97008 7.90789 8.51683 8.94838 11.7679 6.21271 numMergedOcc 0
7 mol 173 unq 1 iso 0 dist 5.97008 4.13397 8.00155 8.94838 11.7679 8.94895 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 9.45847 5.67457 12.5274 8.2618 11.7115 6.96132 numMergedOcc 0
9 mol 184 unq 1 iso 0 dist 7.895 5.67457 8.33714 8.2618 11.4784 6.96132 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 8.88067 8.86708 8.18231 5.89269 13.7743 9.98534 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 7.35148 9.55264 13.2318 16.743 21.1881 8.8955 numMergedOcc 0
12 mol 280 unq 0 iso 0 dist 7.02503 7.15389 8.27425 9.6632 14.0501 7.06977 numMergedOcc 0
13 mol 280 unq 1 iso 0 dist 8.57733 7.70759 9.99391 5.97333 13.5117 7.06977 numMergedOcc 0
14 mol 280 unq 2 iso 0 dist 9.05509 7.70759 8.05876 5.97333 12.4313 7.06977 numMergedOcc 0
15 mol 294 unq 0 iso 0 dist 8.60441 8.19745 10.1933 10.5548 12.9052 7.67337 numMergedOcc 0
16 mol 294 unq 1 iso 0 dist 6.97558 8.19745 6.63396 10.5548 11.7027 7.67337 numMergedOcc 0
