0 mol 8 unq 0 iso 0 dist 9.73496 8.82216 8.80278 5.53899 9.36839 4.35292 12.0843 4.43686 8.37509 9.66021 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 6.57452 6.39837 7.33546 11.6815 9.22636 7.83359 13.0768 14.0643 9.01561 15.4236 numMergedOcc 0
2 mol 86 unq 0 iso 0 dist 8.45341 9.68657 8.4254 5.16705 9.62655 8.47281 14.4441 8.49831 9.34342 15.7745 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 5.8915 9.17593 8.70106 8.5691 7.81042 11.4822 15.0008 13.5214 6.13194 14.7058 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 6.79014 9.85586 9.15982 4.97361 9.6874 14.0132 10.7956 4.45081 9.03707 14.0674 numMergedOcc 0
5 mol 148 unq 0 iso 0 dist 6.4413 11.3382 6.72591 13.2694 9.71692 7.50382 16.7261 11.2206 6.81055 6.58752 numMergedOcc 0
6 mol 150 unq 0 iso 0 dist 6.62609 11.5334 6.80192 13.3379 9.73708 7.48524 16.8389 11.1844 6.77966 6.62442 numMergedOcc 0
7 mol 189 unq 0 iso 0 dist 6.77351 10.3814 8.81184 6.32602 8.23197 12.7403 12.4713 6.53924 9.22035 11.5546 numMergedOcc 0
8 mol 189 unq 1 iso 0 dist 8.4676 16.383 8.81184 9.84174 8.23197 12.7403 14.2892 6.53924 9.22035 11.5546 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 5.99718 4.55979 7.42784 9.55761 8.23246 10.5635 12.5695 9.54701 9.99489 10.238 numMergedOcc 0
10 mol 220 unq 1 iso 0 dist 5.99718 6.35303 6.11123 9.55761 8.23246 4.84006 12.5695 9.54701 7.78448 10.238 numMergedOcc 0
11 mol 226 unq 0 iso 0 dist 6.3687 7.95454 7.6174 12.3798 7.20862 8.00807 13.0812 11.8711 6.93858 10.802 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 7.95918 9.01244 9.94532 4.96171 8.13696 5.75427 12.3791 10.2094 4.49691 9.07261 numMergedOcc 0
