0 mol 10 unq 0 iso 0 dist 6.02543 9.61828 6.18431 12.669 7.14537 5.83346 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 6.02543 9.61828 6.18431 11.4402 9.39486 4.99208 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 7.90721 5.45023 6.7142 4.39827 8.96682 5.39199 numMergedOcc 0
3 mol 39 unq 0 iso 0 dist 6.41793 5.14532 6.13351 6.3982 5.27182 3.91611 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 8.04168 10.6438 6.5551 9.34648 8.7515 9.51372 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 6.98037 8.67827 6.59716 8.11408 9.99441 11.7168 numMergedOcc 0
6 mol 105 unq 0 iso 0 dist 7.44838 4.22355 7.77089 9.94027 9.17843 13.4342 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 7.34602 12.2538 8.06134 9.02942 6.96745 10.3457 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 7.34602 8.49846 5.36587 9.02942 6.96745 3.99855 numMergedOcc 0
9 mol 112 unq 2 iso 0 dist 5.43933 5.91698 7.67238 10.4065 6.96745 10.6938 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.77921 5.38571 6.65731 5.25982 7.92216 10.0208 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 8.612 6.60479 5.06564 6.78032 9.29944 10.0079 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 8.612 7.54337 7.5373 6.78032 9.29944 9.05366 numMergedOcc 0
13 mol 170 unq 0 iso 0 dist 5.13268 7.29587 6.47164 8.5768 8.75024 5.04147 numMergedOcc 0
14 mol 170 unq 1 iso 0 dist 5.13268 8.73585 9.65126 8.5768 8.75024 10.518 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 6.34234 6.0634 6.22742 10.9712 8.22795 5.45812 numMergedOcc 0
16 mol 195 unq 1 iso 0 dist 7.87972 11.4252 9.24936 8.68163 6.396 5.66395 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 8.21997 4.23527 5.31416 6.28124 8.25329 3.94038 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 7.8744 8.98957 6.94762 6.05548 9.3502 5.8463 numMergedOcc 0
19 mol 225 unq 1 iso 0 dist 7.8744 6.59663 7.7086 6.05548 9.3502 6.67492 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 9.43618 12.8075 9.18728 14.9695 8.85955 8.62578 numMergedOcc 0
21 mol 227 unq 1 iso 0 dist 9.43618 12.8075 9.18728 11.2819 6.09335 10.5007 numMergedOcc 0
22 mol 227 unq 2 iso 0 dist 9.43618 4.59123 8.91971 14.9695 8.85955 15.624 numMergedOcc 0
23 mol 227 unq 3 iso 0 dist 9.43618 4.59123 8.91971 11.2819 6.09335 12.8337 numMergedOcc 0
24 mol 235 unq 0 iso 0 dist 9.11454 5.92143 8.97952 10.0222 6.03081 10.6687 numMergedOcc 0
25 mol 235 unq 1 iso 0 dist 9.11454 5.92143 8.97952 6.89973 7.41433 10.6919 numMergedOcc 0
26 mol 236 unq 0 iso 0 dist 9.14068 5.92456 6.15635 8.32937 8.93212 3.86189 numMergedOcc 0
27 mol 273 unq 0 iso 0 dist 5.4307 9.76492 5.61969 6.87067 9.02537 10.5462 numMergedOcc 0
28 mol 273 unq 1 iso 0 dist 5.4307 11.5256 9.0277 6.87067 9.02537 11.5353 numMergedOcc 0
