0 mol 0 unq 0 iso 0 dist 9.99338 9.64573 6.78251 7.65806 4.99728 9.19007 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.99338 16.1331 6.43144 15.3236 6.40255 6.26831 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 9.99338 6.05328 8.69282 7.65806 4.99728 9.56794 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 8.13129 7.29879 6.78251 12.8912 4.99728 9.19007 numMergedOcc 0
4 mol 0 unq 4 iso 0 dist 8.13129 6.34883 6.43144 9.6994 6.40255 6.26831 numMergedOcc 0
5 mol 0 unq 5 iso 0 dist 8.13129 10.5439 8.69282 12.8912 4.99728 9.56794 numMergedOcc 0
6 mol 0 unq 6 iso 0 dist 9.07223 11.9599 6.78251 13.1231 4.99728 9.19007 numMergedOcc 0
7 mol 0 unq 7 iso 0 dist 9.07223 9.19662 6.43144 7.15528 6.40255 6.26831 numMergedOcc 0
8 mol 0 unq 8 iso 0 dist 9.07223 10.4442 8.69282 13.1231 4.99728 9.56794 numMergedOcc 0
9 mol 7 unq 0 iso 0 dist 7.5706 14.6803 7.12105 11.0773 4.87279 5.72491 numMergedOcc 0
10 mol 7 unq 1 iso 0 dist 7.5706 14.6803 7.12105 16.7601 10.6847 7.88043 numMergedOcc 0
11 mol 7 unq 2 iso 0 dist 6.28925 10.2446 7.12105 10.5461 4.87279 5.72491 numMergedOcc 0
12 mol 7 unq 3 iso 0 dist 6.28925 10.2446 7.12105 8.41585 10.6847 7.88043 numMergedOcc 0
13 mol 7 unq 4 iso 0 dist 8.70159 5.44992 7.12105 7.10621 4.87279 5.72491 numMergedOcc 0
14 mol 7 unq 5 iso 0 dist 8.70159 5.44992 7.12105 12.2333 10.6847 7.88043 numMergedOcc 0
15 mol 8 unq 0 iso 0 dist 5.89134 6.32152 7.14096 10.5239 5.92151 7.8922 numMergedOcc 0
16 mol 56 unq 0 iso 0 dist 9.36071 6.03623 5.6727 8.66265 5.19333 6.77886 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 9.70093 13.52 9.69257 16.4353 11.3981 7.77116 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 6.69217 3.78311 9.69257 8.73993 11.3981 7.77116 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 9.64695 8.28698 6.85886 13.268 5.47259 6.76699 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 4.51266 5.74088 6.85886 6.29155 5.47259 6.76699 numMergedOcc 0
21 mol 170 unq 0 iso 0 dist 6.36868 5.95519 6.79696 12.8281 9.77705 8.15099 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 6.95549 8.68081 9.24943 9.29945 5.32538 6.4318 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 6.95549 12.5754 9.58615 9.29945 5.32538 7.35824 numMergedOcc 0
24 mol 175 unq 2 iso 0 dist 6.95549 10.0424 6.83568 9.29945 5.32538 9.17364 numMergedOcc 0
25 mol 178 unq 0 iso 0 dist 7.12045 9.79302 7.88301 7.17202 6.39077 4.92088 numMergedOcc 0
26 mol 178 unq 1 iso 0 dist 8.94945 8.65097 7.88301 8.81551 6.39077 4.92088 numMergedOcc 0
27 mol 229 unq 0 iso 0 dist 7.77578 5.14473 4.96527 10.95 5.31837 8.92743 numMergedOcc 0
28 mol 229 unq 1 iso 0 dist 7.77578 5.14473 4.96527 12.5893 5.64514 8.08082 numMergedOcc 0
29 mol 229 unq 2 iso 0 dist 7.77578 5.14473 4.96527 10.0037 6.39663 5.77318 numMergedOcc 0
30 mol 229 unq 3 iso 0 dist 7.77578 5.14473 4.96527 12.0293 11.7737 8.19603 numMergedOcc 0
31 mol 229 unq 4 iso 0 dist 7.38552 9.62106 4.96527 7.03423 5.31837 8.92743 numMergedOcc 0
32 mol 229 unq 5 iso 0 dist 7.38552 9.62106 4.96527 12.3823 5.64514 8.08082 numMergedOcc 0
33 mol 229 unq 6 iso 0 dist 7.38552 9.62106 4.96527 11.4362 6.39663 5.77318 numMergedOcc 0
34 mol 229 unq 7 iso 0 dist 7.38552 9.62106 4.96527 17.78 11.7737 8.19603 numMergedOcc 0
35 mol 252 unq 0 iso 0 dist 6.68262 6.66384 7.19006 11.3142 12.0836 6.11473 numMergedOcc 0
36 mol 264 unq 0 iso 0 dist 8.29556 4.48907 6.74637 10.4298 8.59461 6.04162 numMergedOcc 0
37 mol 264 unq 1 iso 0 dist 8.29556 4.48907 6.74637 9.90113 11.697 6.14323 numMergedOcc 0
38 mol 264 unq 2 iso 0 dist 8.47755 9.09085 6.74637 14.2152 8.59461 6.04162 numMergedOcc 0
39 mol 264 unq 3 iso 0 dist 8.47755 9.09085 6.74637 14.5869 11.697 6.14323 numMergedOcc 0
