0 mol 0 unq 0 iso 0 dist 9.23213 6.26831 4.04089 5.24778 8.34244 6.64713 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 6.00439 7.48847 6.34272 4.42145 9.85134 11.5929 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 6.00439 7.48847 6.34272 6.42867 5.82366 6.39966 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 7.82528 6.92532 6.34272 15.119 9.85134 11.5929 numMergedOcc 0
4 mol 19 unq 3 iso 0 dist 7.82528 6.92532 6.34272 4.97119 5.82366 6.39966 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 6.46761 7.27383 9.17656 5.85698 9.11258 6.62229 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 7.58407 7.27383 10.8775 11.387 8.71468 15.6714 numMergedOcc 0
7 mol 70 unq 0 iso 0 dist 8.33704 9.31969 11.6542 6.50609 9.48582 14.5461 numMergedOcc 0
8 mol 70 unq 1 iso 0 dist 7.92394 6.54023 11.6542 8.34216 9.48582 14.5461 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.70133 7.04044 11.2505 5.11416 7.10439 6.48232 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 4.65521 8.73253 11.2505 6.56633 7.10439 6.48232 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 8.19682 4.79949 8.83525 6.45686 7.03226 10.489 numMergedOcc 0
12 mol 76 unq 1 iso 0 dist 8.19682 7.27693 5.77727 6.45686 7.03226 9.75201 numMergedOcc 0
13 mol 100 unq 0 iso 0 dist 8.72704 9.00544 14.6145 10.6245 6.0652 18.7621 numMergedOcc 0
14 mol 100 unq 1 iso 0 dist 8.72704 7.12017 6.00843 10.6245 6.0652 10.3304 numMergedOcc 0
15 mol 115 unq 0 iso 0 dist 6.99777 5.74857 6.03931 5.22052 5.60389 8.85881 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 9.63176 7.77116 8.96522 15.5019 7.26955 16.0882 numMergedOcc 0
17 mol 126 unq 0 iso 0 dist 7.75534 9.46588 5.83002 6.0268 7.36017 5.94233 numMergedOcc 0
18 mol 126 unq 1 iso 0 dist 7.75534 9.46588 5.83002 8.01268 5.14819 8.56219 numMergedOcc 0
19 mol 126 unq 2 iso 0 dist 7.75534 9.46588 5.83002 10.2072 6.84245 11.9246 numMergedOcc 0
20 mol 134 unq 0 iso 0 dist 8.79571 8.20836 9.65798 4.57832 8.73604 9.30061 numMergedOcc 0
21 mol 134 unq 1 iso 0 dist 8.6355 5.53031 11.9544 5.71679 8.73604 10.0154 numMergedOcc 0
22 mol 141 unq 0 iso 0 dist 6.93652 6.69515 8.00633 7.42649 5.26989 6.94988 numMergedOcc 0
23 mol 141 unq 1 iso 0 dist 6.93652 6.69515 8.00633 10.6531 7.76442 13.147 numMergedOcc 0
24 mol 156 unq 0 iso 0 dist 7.36119 7.73169 14.0853 5.81563 6.05323 12.9107 numMergedOcc 0
25 mol 156 unq 1 iso 0 dist 7.36119 5.38091 5.33988 5.81563 6.05323 7.46845 numMergedOcc 0
26 mol 175 unq 0 iso 0 dist 9.52634 5.4969 11.4433 6.77832 8.99988 10.791 numMergedOcc 0
27 mol 175 unq 1 iso 0 dist 9.52634 6.4318 6.38017 6.77832 8.99988 10.2009 numMergedOcc 0
28 mol 175 unq 2 iso 0 dist 9.52634 7.35824 6.05776 6.77832 8.99988 5.60528 numMergedOcc 0
29 mol 175 unq 3 iso 0 dist 9.52634 9.17364 5.85047 6.77832 8.99988 5.5995 numMergedOcc 0
30 mol 181 unq 0 iso 0 dist 6.94688 6.51749 10.4684 6.6251 9.06217 10.8541 numMergedOcc 0
31 mol 181 unq 1 iso 0 dist 6.71012 6.51749 12.69 6.6251 7.13252 10.8541 numMergedOcc 0
32 mol 194 unq 0 iso 0 dist 6.95408 6.96521 4.05564 5.43725 9.86703 7.74683 numMergedOcc 0
33 mol 194 unq 1 iso 0 dist 5.48258 8.83356 7.69247 7.11753 8.52969 5.68348 numMergedOcc 0
34 mol 227 unq 0 iso 0 dist 8.17891 8.38865 5.92529 10.9607 7.57454 12.135 numMergedOcc 0
35 mol 227 unq 1 iso 0 dist 6.95902 5.4694 5.92529 9.72615 7.57454 12.135 numMergedOcc 0
36 mol 227 unq 2 iso 0 dist 8.83563 5.87815 4.3387 6.67321 9.28891 7.95359 numMergedOcc 0
37 mol 234 unq 0 iso 0 dist 9.5707 7.5366 16.5499 10.0059 7.43663 16.6111 numMergedOcc 0
38 mol 253 unq 0 iso 0 dist 7.19465 7.77998 14.5407 5.78064 9.58354 8.15091 numMergedOcc 0
39 mol 257 unq 0 iso 0 dist 7.27505 9.69696 5.04668 6.74593 8.60481 9.43042 numMergedOcc 0
