0 mol 61 unq 0 iso 0 dist 5.97418 8.06956 9.42807 9.33927 9.12873 16.6066 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 7.33546 7.33408 10.5803 5.14497 8.72237 10.5012 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 7.33546 7.92149 11.6395 5.14497 8.72237 13.0401 numMergedOcc 0
3 mol 71 unq 0 iso 0 dist 5.75102 8.25891 10.2512 5.31671 9.3877 12.469 numMergedOcc 0
4 mol 104 unq 0 iso 0 dist 6.14066 7.00359 5.78815 8.5613 5.46461 9.85189 numMergedOcc 0
5 mol 104 unq 1 iso 0 dist 6.14066 9.41597 10.2942 8.5613 5.46461 12.6823 numMergedOcc 0
6 mol 125 unq 0 iso 0 dist 4.81596 9.99265 8.93264 5.29844 6.31546 13.9385 numMergedOcc 0
7 mol 136 unq 0 iso 0 dist 8.06032 7.79731 11.3247 7.19078 5.00698 13.0769 numMergedOcc 0
8 mol 165 unq 0 iso 0 dist 3.87901 7.29604 6.27901 6.29065 8.19939 6.62466 numMergedOcc 0
9 mol 165 unq 1 iso 0 dist 5.04534 9.21329 6.27901 7.20557 8.19939 6.62466 numMergedOcc 0
10 mol 174 unq 0 iso 0 dist 5.11555 9.68098 7.64386 6.43119 8.46781 8.01462 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 9.39563 6.66619 12.9481 11.4233 8.11014 13.8657 numMergedOcc 0
12 mol 192 unq 0 iso 0 dist 5.99974 5.37285 9.37081 10.3962 8.43359 15.3103 numMergedOcc 0
13 mol 247 unq 0 iso 0 dist 6.56182 7.80979 11.1248 12.66 8.7797 19.3453 numMergedOcc 0
14 mol 247 unq 1 iso 0 dist 5.32075 7.80979 7.17401 5.03659 6.23164 10.3961 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 8.27377 7.0141 10.9761 9.97671 8.2681 13.5907 numMergedOcc 0
16 mol 285 unq 0 iso 0 dist 4.09984 8.6446 8.66375 8.15057 7.85044 12.2157 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 9.11602 9.13071 11.7624 9.45859 7.64715 14.8389 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 9.11602 9.13071 11.7624 14.2612 8.50508 16.3372 numMergedOcc 0
19 mol 287 unq 2 iso 0 dist 9.11602 8.19596 5.58788 9.45859 7.64715 11.1461 numMergedOcc 0
20 mol 287 unq 3 iso 0 dist 9.11602 8.19596 5.58788 14.2612 8.50508 11.9996 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 9.11602 9.13071 11.7624 9.45859 7.64715 14.8389 numMergedOcc 0
22 mol 288 unq 1 iso 0 dist 9.11602 9.13071 11.7624 14.2612 8.50508 16.3372 numMergedOcc 0
23 mol 288 unq 2 iso 0 dist 9.11602 8.19596 5.58788 9.45859 7.64715 11.1461 numMergedOcc 0
24 mol 288 unq 3 iso 0 dist 9.11602 8.19596 5.58788 14.2612 8.50508 11.9996 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 9.11602 9.13071 11.7624 9.45859 7.64715 14.8389 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 9.11602 9.13071 11.7624 14.2612 8.50508 16.3372 numMergedOcc 0
27 mol 289 unq 2 iso 0 dist 9.11602 8.19596 5.58788 9.45859 7.64715 11.1461 numMergedOcc 0
28 mol 289 unq 3 iso 0 dist 9.11602 8.19596 5.58788 14.2612 8.50508 11.9996 numMergedOcc 0
