0 mol 7 unq 0 iso 0 dist 8.62699 7.21217 14.3668 5.07985 13.6447 6.1206 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.62699 7.21217 14.3668 6.83196 14.7027 7.67927 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 9.70374 7.45487 10.1093 9.29802 16.8517 9.01112 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 9.34846 9.90845 6.85527 10.5945 13.2885 8.09311 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 9.34846 9.90845 6.85527 17.5782 15.6528 9.05357 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 9.45622 6.80741 10.6193 14.8094 13.2502 9.2898 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.24151 6.83992 8.73236 4.74638 6.55112 8.13108 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.53895 9.42766 8.82375 16.57 15.6381 7.64052 numMergedOcc 0
8 mol 182 unq 0 iso 0 dist 8.63031 7.86625 8.27268 4.82437 12.4766 9.56028 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 6.94326 7.66381 5.5366 6.01218 6.84679 7.2793 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 6.94326 7.66381 5.5366 5.27656 9.25077 9.51091 numMergedOcc 0
11 mol 186 unq 2 iso 0 dist 6.94326 7.66381 5.5366 13.9441 13.2691 7.85184 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 8.03534 8.43584 16.0759 14.6356 22.1994 6.49765 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 9.24348 6.97859 4.88904 5.84459 8.43994 9.21377 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 8.65729 9.75313 6.57808 3.56689 8.565 8.08349 numMergedOcc 0
15 mol 224 unq 1 iso 0 dist 9.9137 6.08709 6.57808 11.4272 8.565 8.08349 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 6.66413 7.93997 6.82055 7.06301 9.51375 5.85442 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 6.66413 7.93997 6.82055 7.80863 11.5486 6.95511 numMergedOcc 0
18 mol 276 unq 0 iso 0 dist 8.26741 9.05218 11.2406 5.58312 13.3254 8.6759 numMergedOcc 0
