0 mol 44 unq 0 iso 0 dist 4.52881 9.52676 6.30672 9.32021 8.6578 7.03307 numMergedOcc 0
1 mol 119 unq 0 iso 0 dist 6.61966 9.10479 6.34278 8.3604 10.1832 7.91683 numMergedOcc 0
2 mol 131 unq 0 iso 0 dist 6.30762 8.74658 6.14427 6.53994 7.5344 5.56627 numMergedOcc 0
3 mol 131 unq 1 iso 0 dist 6.30762 8.74658 6.14427 13.4383 14.0971 8.50562 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 7.09597 9.32254 10.3064 5.90381 11.4159 7.82544 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 7.09597 9.32254 10.3064 8.60202 12.6454 6.18808 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 8.84415 9.45931 16.5733 12.0446 18.948 6.73983 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 8.84415 9.45931 16.5733 15.1652 22.9285 8.6387 numMergedOcc 0
8 mol 141 unq 2 iso 0 dist 8.84415 6.35397 11.5144 12.0446 18.948 7.64956 numMergedOcc 0
9 mol 153 unq 0 iso 0 dist 9.40527 9.92288 10.1727 7.76711 9.60661 7.3061 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 9.57307 6.97467 10.6587 7.94812 15.1569 7.46845 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 8.22366 6.97467 5.46268 7.94812 12.1898 7.46845 numMergedOcc 0
12 mol 156 unq 2 iso 0 dist 8.67045 6.97467 10.2977 7.94812 8.86912 7.46845 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 8.54162 8.04856 10.0929 9.14827 14.7026 8.52103 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 9.10711 9.47112 12.1273 11.7574 17.3344 8.07076 numMergedOcc 0
15 mol 205 unq 1 iso 0 dist 9.10711 9.47112 12.1273 12.8469 15.8151 5.95375 numMergedOcc 0
16 mol 205 unq 2 iso 0 dist 9.10711 9.47112 12.1273 15.0925 15.6606 9.17946 numMergedOcc 0
17 mol 205 unq 3 iso 0 dist 8.94211 9.47112 12.9768 11.7574 18.8971 8.07076 numMergedOcc 0
18 mol 205 unq 4 iso 0 dist 8.94211 9.47112 12.9768 12.8469 18.4505 5.95375 numMergedOcc 0
19 mol 205 unq 5 iso 0 dist 8.94211 9.47112 12.9768 15.0925 20.4334 9.17946 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 8.81333 6.78301 11.0048 12.2119 14.4944 6.07878 numMergedOcc 0
