0 mol 27 unq 0 iso 0 dist 9.88299 9.53382 8.14402 10.1674 12.1199 6.78936 numMergedOcc 0
1 mol 72 unq 0 iso 0 dist 8.71615 8.16985 11.9225 5.00053 10.9109 9.14817 numMergedOcc 0
2 mol 72 unq 1 iso 0 dist 8.71615 7.81344 13.3667 5.00053 10.9109 9.76686 numMergedOcc 0
3 mol 72 unq 2 iso 0 dist 8.71615 5.49421 8.89293 5.00053 10.9109 9.437 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 9.37708 7.77418 5.96497 10.9659 7.12413 6.12922 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 7.26463 6.88175 4.80926 10.06 11.1985 6.55202 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 7.94564 6.41759 4.77133 6.63186 10.0693 5.52149 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 9.21999 6.41759 4.56331 6.63186 8.33489 5.52149 numMergedOcc 0
8 mol 135 unq 0 iso 0 dist 7.54797 9.13739 8.91766 4.51614 9.16513 7.6337 numMergedOcc 0
9 mol 173 unq 0 iso 0 dist 9.17063 8.51691 10.1842 9.61315 9.25763 8.62366 numMergedOcc 0
10 mol 173 unq 1 iso 0 dist 9.99332 8.51691 7.24163 9.61315 9.63102 8.62366 numMergedOcc 0
11 mol 173 unq 2 iso 0 dist 7.13369 8.51691 5.48443 9.61315 11.7679 8.62366 numMergedOcc 0
12 mol 193 unq 0 iso 0 dist 9.16852 8.28942 9.98298 6.8779 12.2094 5.79911 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 5.69733 6.91906 4.112 5.24956 6.35728 8.70987 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 9.92947 5.88041 15.6142 5.56344 13.1552 5.73591 numMergedOcc 0
15 mol 224 unq 1 iso 0 dist 9.92947 5.88041 15.6142 7.256 13.7997 8.55345 numMergedOcc 0
16 mol 224 unq 2 iso 0 dist 7.46044 5.88041 3.56689 5.56344 9.04427 5.73591 numMergedOcc 0
17 mol 224 unq 3 iso 0 dist 7.46044 5.88041 3.56689 7.256 11.833 8.55345 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 8.33254 8.03092 14.4546 11.4002 11.3833 9.74902 numMergedOcc 0
19 mol 267 unq 0 iso 0 dist 5.32643 4.42902 4.74052 6.07755 8.93951 6.32877 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 6.15136 8.39635 8.90736 11.0363 14.2367 9.60574 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 8.38071 9.02411 7.00626 9.26331 13.5097 9.69262 numMergedOcc 0
22 mol 284 unq 1 iso 0 dist 7.80784 9.02411 6.34668 9.26331 9.1161 9.69262 numMergedOcc 0
