0 mol 5 unq 0 iso 0 dist 8.88048 6.77563 9.72215 5.2522 11.3768 9.17088 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 9.5937 6.53817 10.1064 11.2244 18.292 8.58312 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 7.34681 6.53817 13.5023 11.2244 17.9185 8.58312 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 7.69637 6.85331 9.1927 5.75364 12.6968 8.0319 numMergedOcc 0
4 mol 33 unq 0 iso 0 dist 8.37901 5.66319 7.83082 9.147 12.7461 5.52992 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 7.43409 8.04926 3.73188 4.85596 6.43837 8.7361 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 8.86433 9.10915 14.8927 14.1348 19.7153 8.75668 numMergedOcc 0
7 mol 64 unq 1 iso 0 dist 5.66803 5.54343 5.9853 8.45243 7.32896 8.75668 numMergedOcc 0
8 mol 64 unq 2 iso 0 dist 8.85416 9.99634 6.43864 15.3613 7.32896 9.64871 numMergedOcc 0
9 mol 67 unq 0 iso 0 dist 8.27009 8.64208 13.0612 4.94708 12.0864 9.2223 numMergedOcc 0
10 mol 67 unq 1 iso 0 dist 5.80736 8.64208 11.8891 4.94708 10.4699 9.2223 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 9.42014 5.81552 6.29923 4.56801 13.8087 9.90769 numMergedOcc 0
12 mol 140 unq 0 iso 0 dist 9.13339 8.28732 7.94378 6.58715 13.6215 8.92292 numMergedOcc 0
13 mol 159 unq 0 iso 0 dist 9.54337 8.55431 12.3309 11.1479 16.8062 6.25034 numMergedOcc 0
14 mol 159 unq 1 iso 0 dist 6.86212 8.55431 5.10423 11.1479 10.8756 6.25034 numMergedOcc 0
15 mol 159 unq 2 iso 0 dist 9.9368 8.55431 7.18851 11.1479 11.9881 6.25034 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 6.59407 9.42819 9.00663 7.51816 11.132 7.69229 numMergedOcc 0
17 mol 171 unq 0 iso 0 dist 6.19457 6.01711 6.89436 6.8538 12.2995 7.73971 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 7.82201 9.40003 17.1162 14.5553 20.9856 9.92165 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 6.39087 7.30244 12.2765 17.06 22.0724 9.9693 numMergedOcc 0
20 mol 220 unq 1 iso 0 dist 9.86144 9.58343 12.2765 18.4618 22.0724 9.9693 numMergedOcc 0
21 mol 220 unq 2 iso 0 dist 9.89039 8.9077 13.6952 8.20682 14.2856 5.39218 numMergedOcc 0
22 mol 220 unq 3 iso 0 dist 8.57174 8.9077 13.8822 8.20682 9.51136 5.39218 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 8.63249 6.36941 7.45579 13.8826 13.7761 7.87233 numMergedOcc 0
24 mol 250 unq 0 iso 0 dist 8.69437 5.32724 5.58623 6.93378 8.4116 9.22082 numMergedOcc 0
25 mol 261 unq 0 iso 0 dist 7.58385 8.50313 6.88989 7.35046 10.8849 7.00833 numMergedOcc 0
26 mol 261 unq 1 iso 0 dist 6.0437 8.50313 4.25662 7.35046 8.50063 7.00833 numMergedOcc 0
27 mol 261 unq 2 iso 0 dist 4.85199 7.6414 4.25662 7.98909 8.50063 7.00833 numMergedOcc 0
28 mol 261 unq 3 iso 0 dist 9.72159 7.6414 12.864 7.98909 16.4803 7.00833 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 9.34051 9.81087 7.24261 6.75848 10.5453 8.41236 numMergedOcc 0
30 mol 280 unq 0 iso 0 dist 9.76967 9.26066 18.1328 4.68825 13.3526 5.41639 numMergedOcc 0
