0 mol 7 unq 0 iso 0 dist 8.57437 17.7278 9.85726 18.947 10.4879 7.32392 15.262 11.5784 9.60499 15.5277 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 9.42142 5.63648 8.39221 10.9956 6.09608 6.89209 8.13983 7.00835 6.38364 5.49061 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 9.56648 10.1011 8.67719 13.8231 9.57729 6.84569 12.9591 6.53177 5.46498 5.46269 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.18109 5.66535 6.87871 10.3807 5.41061 5.2422 13.8432 8.95909 9.24927 5.74753 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 9.82315 7.49081 5.92705 9.91313 6.47853 9.70415 10.5781 5.4671 6.65721 5.46309 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 9.82315 7.49081 5.92705 9.91313 6.47853 9.70415 12.4244 10.1513 6.72123 11.9897 numMergedOcc 0
6 mol 61 unq 2 iso 0 dist 9.67403 4.90701 9.62468 14.542 14.0458 9.70415 11.0419 10.7369 6.65721 5.46309 numMergedOcc 0
7 mol 61 unq 3 iso 0 dist 9.67403 4.90701 9.62468 14.542 14.0458 9.70415 8.46556 11.5608 6.72123 11.9897 numMergedOcc 0
8 mol 61 unq 4 iso 0 dist 7.28917 16.7918 9.62468 20.6191 14.0458 9.70415 17.6513 10.7369 6.65721 5.46309 numMergedOcc 0
9 mol 61 unq 5 iso 0 dist 7.28917 16.7918 9.62468 20.6191 14.0458 9.70415 18.1412 11.5608 6.72123 11.9897 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 7.66832 9.47324 8.21889 11.6716 5.07258 7.51061 8.73648 5.5332 7.34473 5.29855 numMergedOcc 0
11 mol 109 unq 1 iso 0 dist 8.11083 12.7688 8.21889 13.0316 5.07258 7.51061 12.2141 5.5332 7.34473 5.29855 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 6.81489 10.0087 7.70533 14.8475 10.7285 7.0318 12.479 6.29427 9.84395 8.12649 numMergedOcc 0
13 mol 117 unq 1 iso 0 dist 6.81489 10.0087 7.70533 14.8475 10.7285 7.0318 17.1533 14.3476 7.90328 5.21051 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 6.67306 8.8283 9.42766 14.6377 10.604 8.62648 16.7151 14.0677 8.73993 4.6251 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 9.46728 11.9383 6.83152 14.6951 7.10888 6.06422 18.0919 10.8336 6.57393 5.33697 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 9.46728 9.23693 5.24313 9.69906 12.2489 7.64276 14.9617 12.1448 7.31233 7.45873 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 6.83278 13.5373 9.82774 20.1796 14.331 8.83775 16.7479 10.5903 8.44326 4.66992 numMergedOcc 0
