0 mol 4 unq 0 iso 0 dist 6.12485 6.66589 6.56189 7.88748 4.10578 4.90612 6.21697 6.86951 9.80478 10.4152 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 8.27009 7.9572 10.6864 6.44825 11.2455 9.25732 10.6111 6.04303 15.2666 15.1642 numMergedOcc 0
2 mol 67 unq 1 iso 0 dist 8.27009 7.9572 10.6864 6.44825 11.2455 9.25732 6.9953 6.12267 13.4813 10.4907 numMergedOcc 0
3 mol 67 unq 2 iso 0 dist 8.27009 8.64208 13.0612 6.44825 11.2455 13.625 10.6111 6.04303 14.601 15.1642 numMergedOcc 0
4 mol 67 unq 3 iso 0 dist 8.27009 8.64208 13.0612 6.44825 11.2455 13.625 6.9953 6.12267 13.9132 10.4907 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 7.48127 4.83274 10.6009 6.97936 6.1999 6.77898 10.0928 5.73235 11.7544 6.14248 numMergedOcc 0
6 mol 168 unq 0 iso 0 dist 9.11481 8.8573 5.06947 7.337 4.66376 4.16504 6.11195 7.41092 9.35182 9.08906 numMergedOcc 0
7 mol 168 unq 1 iso 0 dist 7.41092 9.35182 5.06947 9.08906 4.66376 4.16504 6.11195 9.11481 8.8573 7.337 numMergedOcc 0
8 mol 214 unq 0 iso 0 dist 5.86911 9.4835 13.1789 8.44407 4.54444 13.9529 8.94237 7.82201 17.4836 12.0564 numMergedOcc 0
9 mol 214 unq 1 iso 0 dist 5.86911 9.4835 13.1789 6.0155 7.05353 8.52282 8.94237 7.82201 17.4836 13.7263 numMergedOcc 0
10 mol 214 unq 2 iso 0 dist 5.86911 9.4835 13.1789 8.89981 12.9344 8.48942 8.94237 7.82201 17.4836 13.0479 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 6.39087 7.30244 12.2765 8.63649 4.4227 14.9028 6.99846 9.86144 9.58343 13.5602 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 6.39087 7.29796 13.2427 8.63649 4.4227 14.1071 6.99846 9.86144 12.0159 13.5602 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 7.25618 9.67877 15.0574 9.6327 11.3267 6.95359 7.64421 8.70193 17.1491 16.844 numMergedOcc 0
14 mol 258 unq 1 iso 0 dist 7.25618 8.81059 4.51422 9.6327 11.3267 13.987 7.64421 8.70193 7.9357 16.844 numMergedOcc 0
15 mol 258 unq 2 iso 0 dist 7.25618 9.12006 4.99997 9.6327 11.3267 15.8856 7.64421 8.70193 5.79537 16.844 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 8.15119 9.84188 10.2486 9.91103 13.1828 19.0436 11.3688 6.66936 15.0284 11.2458 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 8.15119 9.84188 10.2486 7.0603 10.6994 15.7645 11.3688 6.66936 15.0284 9.4543 numMergedOcc 0
18 mol 277 unq 2 iso 0 dist 8.15119 8.35794 7.94155 9.91103 13.1828 17.6038 11.3688 6.66936 14.2462 11.2458 numMergedOcc 0
19 mol 277 unq 3 iso 0 dist 8.15119 8.35794 7.94155 7.0603 10.6994 14.772 11.3688 6.66936 14.2462 9.4543 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 6.45597 7.13655 5.37435 6.06665 5.19406 4.79186 5.69849 9.18785 8.98486 10.6454 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 6.45597 7.13655 5.37435 6.06665 5.19406 4.79186 5.69849 9.18785 8.98486 10.6454 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 6.45597 7.13655 5.37435 6.06665 5.19406 4.79186 5.69849 9.18785 8.98486 10.6454 numMergedOcc 0
