0 mol 7 unq 0 iso 0 dist 9.8592 6.94615 8.88491 7.91041 9.67498 8.94586 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.8592 9.17764 17.6307 7.91041 9.67498 10.4728 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 9.16791 9.71247 7.94795 15.4318 7.09393 13.689 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 9.16791 9.71247 7.94795 11.6163 3.87167 10.887 numMergedOcc 0
4 mol 69 unq 2 iso 0 dist 9.16791 4.95459 9.41369 15.4318 7.09393 15.6682 numMergedOcc 0
5 mol 69 unq 3 iso 0 dist 9.16791 4.95459 9.41369 11.6163 3.87167 12.2243 numMergedOcc 0
6 mol 69 unq 4 iso 0 dist 6.57452 9.71247 10.3982 11.6815 9.22636 18.0891 numMergedOcc 0
7 mol 69 unq 5 iso 0 dist 6.57452 4.95459 5.25902 11.6815 9.22636 11.668 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.23755 8.64736 10.9054 12.5791 8.4438 15.997 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 6.88956 7.74778 4.85893 10.7167 7.57822 10.0099 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 9.614 6.02094 4.38798 9.24302 8.78709 5.67112 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 5.99801 8.41708 5.80701 11.7811 9.45817 15.2324 numMergedOcc 0
12 mol 189 unq 0 iso 0 dist 9.36549 9.6509 6.37312 12.9479 7.04604 9.71563 numMergedOcc 0
13 mol 189 unq 1 iso 0 dist 6.77351 9.6509 6.41248 6.32602 8.23197 13.7292 numMergedOcc 0
14 mol 189 unq 2 iso 0 dist 8.4676 9.31137 13.375 9.84174 8.23197 17.7607 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 7.53036 9.24801 13.6481 8.8592 8.93927 17.0936 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 5.99718 9.36738 6.23427 9.55761 8.23246 13.054 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 6.3687 9.84017 8.87365 12.3798 7.20862 15.3586 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 8.25412 9.45021 6.10844 5.34424 5.2851 7.17024 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 5.46484 5.27184 8.52618 8.95567 7.6402 13.7846 numMergedOcc 0
20 mol 236 unq 1 iso 0 dist 5.46484 7.98527 5.37989 8.95567 7.6402 10.0781 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 7.95918 4.76698 9.60961 4.96171 8.13696 8.81429 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 6.03414 6.9592 7.3159 5.49004 8.87405 8.20933 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 6.85288 5.02385 6.69582 11.71 9.98985 14.9954 numMergedOcc 0
24 mol 279 unq 1 iso 0 dist 6.85288 5.02385 6.69582 10.2918 7.22295 12.4413 numMergedOcc 0
25 mol 280 unq 0 iso 0 dist 3.97964 9.35785 7.98547 8.4621 8.57733 13.9796 numMergedOcc 0
26 mol 280 unq 1 iso 0 dist 3.97964 9.35785 7.98547 10.5502 9.05509 11.0977 numMergedOcc 0
27 mol 280 unq 2 iso 0 dist 7.72152 9.35785 15.3619 10.1323 6.83927 19.2828 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 8.17214 8.51221 6.15563 14.6688 8.63954 11.2232 numMergedOcc 0
29 mol 285 unq 1 iso 0 dist 8.17214 8.51221 6.15563 8.64319 4.74716 8.7964 numMergedOcc 0
