0 mol 1 unq 0 iso 0 dist 8.61411 9.76602 10.4951 5.55519 5.74199 6.2936 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 6.21423 9.45566 6.30672 11.5696 11.7195 9.98746 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 8.48766 9.97781 5.18016 8.47939 10.817 7.65069 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 9.83906 5.51406 11.5684 6.16048 10.1004 6.93893 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.99537 6.37888 7.27534 6.18402 7.12199 5.74593 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 6.61879 7.11127 9.18589 4.24483 10.1013 5.74593 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 6.61879 6.91655 5.90337 4.24483 10.1013 8.02376 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 7.81131 7.11127 9.58876 4.24483 7.90837 5.74593 numMergedOcc 0
8 mol 92 unq 4 iso 0 dist 7.81131 6.91655 5.64135 4.24483 7.90837 8.02376 numMergedOcc 0
9 mol 92 unq 5 iso 0 dist 5.74364 9.18898 9.52463 4.68995 8.67865 6.15654 numMergedOcc 0
10 mol 92 unq 6 iso 0 dist 5.74364 7.67331 6.07224 4.68995 8.67865 7.89887 numMergedOcc 0
11 mol 92 unq 7 iso 0 dist 8.60026 9.18898 9.30089 4.68995 8.40148 6.15654 numMergedOcc 0
12 mol 92 unq 8 iso 0 dist 8.60026 7.67331 5.77554 4.68995 8.40148 7.89887 numMergedOcc 0
13 mol 93 unq 0 iso 0 dist 7.62629 7.4518 10.9752 8.97237 14.7953 7.8962 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 9.44788 9.34823 11.5937 10.5389 16.6378 6.67326 numMergedOcc 0
15 mol 128 unq 0 iso 0 dist 5.4772 8.87314 5.85033 10.3732 10.5498 6.51968 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 9.49104 5.49198 5.45341 8.22726 5.33543 7.50264 numMergedOcc 0
17 mol 141 unq 0 iso 0 dist 6.32669 7.6793 4.8653 3.56357 8.56593 8.71007 numMergedOcc 0
18 mol 147 unq 0 iso 0 dist 6.00651 9.41073 12.6092 7.75436 13.0859 8.40219 numMergedOcc 0
19 mol 147 unq 1 iso 0 dist 8.52428 9.41073 7.24469 7.75436 9.13646 8.40219 numMergedOcc 0
20 mol 148 unq 0 iso 0 dist 6.60739 9.80819 12.193 14.6035 17.0052 7.46919 numMergedOcc 0
21 mol 148 unq 1 iso 0 dist 9.22427 9.80819 14.6053 14.6035 16.0883 7.46919 numMergedOcc 0
22 mol 148 unq 2 iso 0 dist 5.55129 9.80819 11.2269 14.6035 17.7281 7.46919 numMergedOcc 0
23 mol 150 unq 0 iso 0 dist 6.71763 9.81665 12.1772 14.6751 16.9812 7.36989 numMergedOcc 0
24 mol 150 unq 1 iso 0 dist 9.32504 9.81665 14.5231 14.6751 16.0617 7.36989 numMergedOcc 0
25 mol 150 unq 2 iso 0 dist 5.53778 9.81665 11.1674 14.6751 17.639 7.36989 numMergedOcc 0
26 mol 188 unq 0 iso 0 dist 8.48582 9.99421 9.411 9.44575 13.01 6.47305 numMergedOcc 0
27 mol 188 unq 1 iso 0 dist 8.48582 9.37017 8.98299 9.44575 13.01 6.20426 numMergedOcc 0
28 mol 188 unq 2 iso 0 dist 9.94804 9.99421 6.29343 9.44575 11.5844 6.47305 numMergedOcc 0
29 mol 188 unq 3 iso 0 dist 9.94804 9.37017 11.054 9.44575 11.5844 6.20426 numMergedOcc 0
30 mol 197 unq 0 iso 0 dist 7.56537 8.98598 4.91904 5.79567 8.51118 9.87211 numMergedOcc 0
31 mol 197 unq 1 iso 0 dist 7.56537 7.06689 7.59634 5.79567 8.51118 6.3997 numMergedOcc 0
32 mol 197 unq 2 iso 0 dist 9.89975 8.98598 6.79468 5.79567 6.5 9.87211 numMergedOcc 0
33 mol 197 unq 3 iso 0 dist 9.89975 7.06689 5.31205 5.79567 6.5 6.3997 numMergedOcc 0
34 mol 204 unq 0 iso 0 dist 5.67196 8.62191 6.08392 4.72843 7.00683 9.46973 numMergedOcc 0
35 mol 257 unq 0 iso 0 dist 8.9297 8.4302 11.0338 4.65989 6.51449 8.64133 numMergedOcc 0
