0 mol 54 unq 0 iso 0 dist 6.54052 9.45804 5.7405 12.1306 6.32568 10.0942 numMergedOcc 0
1 mol 100 unq 0 iso 0 dist 6.34031 14.7574 9.95103 11.8965 9.18792 5.23 numMergedOcc 0
2 mol 108 unq 0 iso 0 dist 8.50992 10.135 8.06774 10.0665 7.3542 4.68231 numMergedOcc 0
3 mol 108 unq 1 iso 0 dist 8.00008 10.6042 8.06774 6.5597 7.3542 4.68231 numMergedOcc 0
4 mol 108 unq 2 iso 0 dist 7.79698 7.02959 8.06774 3.6703 7.3542 4.68231 numMergedOcc 0
5 mol 108 unq 3 iso 0 dist 7.18748 9.65124 8.06774 11.3566 7.3542 4.68231 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 6.93424 13.0903 7.35385 15.8234 9.03842 8.52311 numMergedOcc 0
7 mol 167 unq 0 iso 0 dist 9.83216 6.20034 9.69399 10.8143 9.32545 6.0151 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 9.13228 13.0222 5.0207 11.4479 9.02161 10.0635 numMergedOcc 0
9 mol 184 unq 1 iso 0 dist 9.13228 13.0222 5.0207 7.88594 8.38137 12.3131 numMergedOcc 0
10 mol 192 unq 0 iso 0 dist 9.9312 13.5387 9.99783 4.68101 7.36742 13.7008 numMergedOcc 0
11 mol 224 unq 0 iso 0 dist 7.62513 9.01559 9.9144 8.77193 8.51608 4.233 numMergedOcc 0
12 mol 249 unq 0 iso 0 dist 6.7282 7.89655 4.68783 12.1107 6.72501 9.43294 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 9.7625 6.7593 5.92532 5.43354 9.04531 3.87167 numMergedOcc 0
