0 mol 7 unq 0 iso 0 dist 7.88043 8.80762 4.95029 12.2041 5.72491 9.67579 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 6.82379 7.92414 10.9776 6.94408 6.24978 14.3545 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 6.82379 7.92414 10.9776 11.2508 9.66439 18.2323 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 6.82379 7.92414 10.9776 12.4076 7.3915 16.4393 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 7.05737 7.57959 5.72847 5.64331 7.54179 11.3557 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.85586 7.11 8.2073 8.07446 5.16364 11.2874 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 9.92283 7.23962 16.3997 5.0812 6.43433 11.778 numMergedOcc 0
7 mol 112 unq 1 iso 0 dist 7.23962 9.92283 16.3997 7.03147 9.00067 15.0894 numMergedOcc 0
8 mol 112 unq 2 iso 0 dist 7.23962 9.92283 16.3997 11.4954 9.89499 19.9082 numMergedOcc 0
9 mol 112 unq 3 iso 0 dist 7.23962 9.92283 16.3997 7.05226 7.30204 14.242 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.56342 6.37542 8.77578 4.85907 7.99857 10.4631 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 8.71039 6.92648 8.59447 5.55373 8.86329 11.4206 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 6.92648 8.71039 8.59447 7.58238 9.15431 13.4438 numMergedOcc 0
13 mol 131 unq 2 iso 0 dist 6.92648 8.71039 8.59447 6.63273 9.29384 11.6142 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 6.2319 9.43259 4.10961 7.14831 9.31851 10.9841 numMergedOcc 0
15 mol 156 unq 1 iso 0 dist 6.2319 9.43259 4.10961 6.31306 9.97732 11.1392 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 6.85302 9.98215 7.61858 5.74635 7.20574 13.6209 numMergedOcc 0
17 mol 207 unq 0 iso 0 dist 7.96797 8.85547 5.03424 11.0921 8.32218 11.3816 numMergedOcc 0
18 mol 212 unq 0 iso 0 dist 6.29767 8.74585 13.9955 4.12932 8.57827 10.5561 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 6.29367 8.86175 11.2353 4.72474 5.76954 6.29511 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 6.29367 8.86175 11.2353 6.17651 9.20961 9.91544 numMergedOcc 0
21 mol 218 unq 2 iso 0 dist 8.86175 6.29367 11.2353 4.72474 6.29511 5.76954 numMergedOcc 0
22 mol 218 unq 3 iso 0 dist 5.76954 8.06216 6.73047 4.72474 6.29367 11.565 numMergedOcc 0
23 mol 218 unq 4 iso 0 dist 5.76954 8.06216 6.73047 5.61978 9.20961 11.5105 numMergedOcc 0
24 mol 218 unq 5 iso 0 dist 5.76954 6.29511 11.2353 4.72474 6.29367 8.86175 numMergedOcc 0
25 mol 218 unq 6 iso 0 dist 5.76954 6.29511 11.2353 5.61978 9.20961 9.91544 numMergedOcc 0
26 mol 218 unq 7 iso 0 dist 6.29511 8.06216 12.255 4.72474 8.86175 11.565 numMergedOcc 0
27 mol 218 unq 8 iso 0 dist 6.29511 5.76954 11.2353 4.72474 8.86175 6.29367 numMergedOcc 0
28 mol 252 unq 0 iso 0 dist 8.47784 6.11473 8.15279 13.2361 8.66469 13.1135 numMergedOcc 0
29 mol 252 unq 1 iso 0 dist 8.47784 6.53679 12.9718 13.2361 8.66469 18.6994 numMergedOcc 0
30 mol 252 unq 2 iso 0 dist 6.53679 6.11473 6.75213 6.0987 7.50201 10.7615 numMergedOcc 0
31 mol 252 unq 3 iso 0 dist 6.53679 8.47784 12.9718 6.0987 7.50201 12.0482 numMergedOcc 0
32 mol 258 unq 0 iso 0 dist 7.99477 7.86627 7.46428 7.26417 6.70815 11.184 numMergedOcc 0
33 mol 258 unq 1 iso 0 dist 7.86627 7.99477 7.46428 5.30627 7.93574 10.711 numMergedOcc 0
