0 mol 46 unq 0 iso 0 dist 8.55031 5.65462 9.81193 9.47718 5.73909 9.27409 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 9.52763 3.63144 9.78973 10.2543 6.07317 8.85981 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 6.98121 5.93743 9.50228 14.2005 12.1829 9.97781 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.93688 12.656 7.44343 14.9666 14.8919 9.18898 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 9.88184 14.9487 7.44343 20.4576 14.8919 9.18898 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 8.52125 12.9454 9.95103 14.2839 14.9354 9.16592 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 5.28955 4.09788 6.13508 11.8884 9.73554 8.4733 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 8.89412 7.25148 9.39811 10.8305 6.87651 8.58172 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 9.48142 4.04072 9.57242 7.7264 5.05407 7.81715 numMergedOcc 0
9 mol 219 unq 0 iso 0 dist 9.52151 12.6614 9.30312 11.9439 6.90398 7.13099 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 8.97523 4.14576 6.6069 10.8194 4.73362 9.79381 numMergedOcc 0
11 mol 225 unq 1 iso 0 dist 8.97523 4.14576 6.6069 8.31651 6.31615 8.37379 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 7.99525 9.77057 9.92671 13.7548 8.30148 9.41148 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 9.20965 9.30551 9.92671 12.5589 8.30148 9.41148 numMergedOcc 0
14 mol 232 unq 2 iso 0 dist 6.11539 6.70882 6.23146 10.8409 8.47021 7.83422 numMergedOcc 0
15 mol 232 unq 3 iso 0 dist 9.71082 14.3107 6.23146 13.1673 8.47021 7.83422 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 7.279 4.20164 4.68783 6.40339 5.34664 6.58109 numMergedOcc 0
17 mol 249 unq 1 iso 0 dist 8.43448 5.93404 4.68783 9.5348 5.34664 6.58109 numMergedOcc 0
18 mol 256 unq 0 iso 0 dist 9.37687 15.2988 7.40057 12.3349 4.29865 5.66817 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 6.83278 4.74121 8.20933 7.79408 4.50533 6.81257 numMergedOcc 0
