0 mol 2 unq 0 iso 0 dist 6.47123 9.39095 10.431 13.3672 9.8324 17.7585 numMergedOcc 0
1 mol 5 unq 0 iso 0 dist 8.70824 4.9568 10.7591 4.91776 6.81899 9.47911 numMergedOcc 0
2 mol 5 unq 1 iso 0 dist 5.93404 4.9568 3.91535 4.91776 8.91509 9.47911 numMergedOcc 0
3 mol 5 unq 2 iso 0 dist 6.70655 4.9568 6.94674 4.91776 7.89217 9.47911 numMergedOcc 0
4 mol 5 unq 3 iso 0 dist 6.70655 4.9568 6.94674 8.54255 6.99733 11.6542 numMergedOcc 0
5 mol 10 unq 0 iso 0 dist 9.38983 8.44792 6.62276 11.2691 7.5169 7.30932 numMergedOcc 0
6 mol 10 unq 1 iso 0 dist 9.38983 4.94198 7.95312 11.2691 7.5169 12.8903 numMergedOcc 0
7 mol 10 unq 2 iso 0 dist 9.38983 9.62353 15.7095 11.2691 7.5169 20.2086 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 7.41861 6.46582 8.58474 7.01534 9.26231 13.1652 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 6.77845 9.94528 4.48523 5.83828 7.9309 12.2134 numMergedOcc 0
10 mol 83 unq 1 iso 0 dist 5.48555 8.94777 4.48523 7.62986 7.9309 12.2134 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 5.81553 9.60648 7.8359 4.49464 6.39026 12.7826 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.56319 8.22722 6.208 6.70307 5.92836 8.32179 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 6.65267 8.22722 3.60683 6.70307 4.73804 8.32179 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 9.73038 8.52036 6.208 12.974 5.92836 8.32179 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 9.87968 8.44389 10.9822 6.21365 6.95133 12.5246 numMergedOcc 0
16 mol 192 unq 0 iso 0 dist 9.78743 5.05414 10.6325 9.99333 5.83093 12.7015 numMergedOcc 0
17 mol 192 unq 1 iso 0 dist 9.78743 7.16964 7.64178 9.99333 5.83093 11.738 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 8.47833 8.93485 6.82382 9.61557 8.27071 11.5105 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 5.47586 5.66636 6.82382 7.43264 8.27071 11.5105 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 4.87053 4.90656 5.63584 6.45821 5.17916 9.95874 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 5.90728 9.35302 12.6455 7.50871 6.93798 16.6953 numMergedOcc 0
22 mol 283 unq 1 iso 0 dist 5.90728 8.85163 7.97597 7.50871 6.93798 9.33601 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 6.19545 6.16127 4.00861 10.5258 9.30394 12.5897 numMergedOcc 0
24 mol 287 unq 1 iso 0 dist 6.19545 6.16127 4.00861 5.45438 5.84467 8.7503 numMergedOcc 0
25 mol 287 unq 2 iso 0 dist 7.3388 6.16127 5.03775 10.5636 9.84741 11.7353 numMergedOcc 0
26 mol 287 unq 3 iso 0 dist 6.96248 6.16127 8.95194 10.5258 8.5458 12.5897 numMergedOcc 0
27 mol 287 unq 4 iso 0 dist 6.96248 6.16127 8.95194 5.45438 8.56533 8.7503 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 6.19545 6.16127 4.00861 10.5258 9.30394 12.5897 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 6.19545 6.16127 4.00861 5.45438 5.84467 8.7503 numMergedOcc 0
30 mol 288 unq 2 iso 0 dist 7.3388 6.16127 5.03775 10.5636 9.84741 11.7353 numMergedOcc 0
31 mol 288 unq 3 iso 0 dist 6.96248 6.16127 8.95194 10.5258 8.5458 12.5897 numMergedOcc 0
32 mol 288 unq 4 iso 0 dist 6.96248 6.16127 8.95194 5.45438 8.56533 8.7503 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 6.19545 6.16127 4.00861 10.5258 9.30394 12.5897 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 6.19545 6.16127 4.00861 5.45438 5.84467 8.7503 numMergedOcc 0
35 mol 289 unq 2 iso 0 dist 7.3388 6.16127 5.03775 10.5636 9.84741 11.7353 numMergedOcc 0
36 mol 289 unq 3 iso 0 dist 6.96248 6.16127 8.95194 10.5258 8.5458 12.5897 numMergedOcc 0
37 mol 289 unq 4 iso 0 dist 6.96248 6.16127 8.95194 5.45438 8.56533 8.7503 numMergedOcc 0
