0 mol 32 unq 0 iso 0 dist 7.18766 7.11053 5.19476 4.84198 5.9972 8.78511 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 7.48825 7.11053 8.73368 4.84198 10.9253 8.78511 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.55901 8.38156 10.4688 12.0023 9.56614 6.52283 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 8.55901 7.79336 10.3961 16.3505 16.5938 9.41098 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 9.03412 8.38156 5.60198 12.0023 10.3175 6.52283 numMergedOcc 0
5 mol 34 unq 3 iso 0 dist 9.03412 7.79336 9.85481 16.3505 18.633 9.41098 numMergedOcc 0
6 mol 39 unq 0 iso 0 dist 8.43814 7.30265 10.9581 10.7428 18.1615 9.17793 numMergedOcc 0
7 mol 39 unq 1 iso 0 dist 8.16689 7.30265 6.18136 10.7428 14.9929 9.17793 numMergedOcc 0
8 mol 59 unq 0 iso 0 dist 6.90952 8.35444 6.61741 3.75088 8.10723 6.23509 numMergedOcc 0
9 mol 72 unq 0 iso 0 dist 9.19459 5.4605 6.74416 9.32129 15.1348 8.80645 numMergedOcc 0
10 mol 72 unq 1 iso 0 dist 9.19459 6.53824 10.7904 9.32129 15.1348 8.39955 numMergedOcc 0
11 mol 72 unq 2 iso 0 dist 8.59747 6.7272 6.74416 10.0349 15.1348 8.80645 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 6.4218 5.73203 5.58312 5.45 10.6429 6.76852 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 6.4218 6.57379 9.61537 5.45 10.6429 4.94473 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 8.55681 4.26972 6.37052 4.48264 11.6867 5.95801 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 8.55681 4.26972 6.37052 12.3921 15.1155 9.92715 numMergedOcc 0
16 mol 193 unq 0 iso 0 dist 6.33838 5.79911 5.4245 4.69617 6.21648 6.94187 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 5.89018 8.66162 4.08137 3.99343 4.51124 7.33774 numMergedOcc 0
18 mol 204 unq 1 iso 0 dist 5.89018 8.66162 4.08137 11.4601 8.41517 6.39122 numMergedOcc 0
19 mol 204 unq 2 iso 0 dist 5.89018 5.3819 9.11693 6.68247 7.76863 8.23717 numMergedOcc 0
20 mol 204 unq 3 iso 0 dist 5.89018 5.3819 9.11693 7.51762 10.2353 7.98864 numMergedOcc 0
21 mol 218 unq 0 iso 0 dist 8.57853 8.61306 16.2592 9.62853 17.8244 6.17843 numMergedOcc 0
22 mol 218 unq 1 iso 0 dist 8.57853 8.61306 16.2592 13.697 21.0053 8.52772 numMergedOcc 0
23 mol 218 unq 2 iso 0 dist 6.75035 8.61306 10.1772 9.62853 14.2224 6.17843 numMergedOcc 0
24 mol 218 unq 3 iso 0 dist 6.75035 8.61306 10.1772 13.697 16.9743 8.52772 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 8.75834 8.91356 3.92979 16.5061 11.9652 8.74463 numMergedOcc 0
26 mol 225 unq 1 iso 0 dist 7.51827 8.91356 13.317 16.5061 20.0266 8.74463 numMergedOcc 0
27 mol 225 unq 2 iso 0 dist 9.36396 9.59574 3.92979 10.2743 11.9652 8.74463 numMergedOcc 0
28 mol 228 unq 0 iso 0 dist 8.37287 7.84881 6.68878 3.65229 8.29523 8.92379 numMergedOcc 0
29 mol 228 unq 1 iso 0 dist 8.07174 7.86746 6.64821 3.62742 8.13557 9.06403 numMergedOcc 0
30 mol 254 unq 0 iso 0 dist 6.03988 9.66641 5.91806 6.19835 6.59989 5.6417 numMergedOcc 0
31 mol 254 unq 1 iso 0 dist 6.03988 9.26575 5.04088 6.19835 6.59989 7.42831 numMergedOcc 0
32 mol 272 unq 0 iso 0 dist 6.75716 8.84523 10.2399 9.97731 13.9595 5.53492 numMergedOcc 0
33 mol 286 unq 0 iso 0 dist 8.81794 7.31896 8.0943 3.74137 6.44288 8.75926 numMergedOcc 0
