0 mol 4 unq 0 iso 0 dist 6.10734 12.7044 8.24634 6.21799 5.58487 7.66731 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 6.48163 11.5195 5.9465 12.5077 9.05259 5.69731 numMergedOcc 0
2 mol 92 unq 1 iso 0 dist 6.48163 11.5567 6.97962 12.5077 9.05259 4.14907 numMergedOcc 0
3 mol 92 unq 2 iso 0 dist 6.48163 10.743 9.95342 12.5077 9.05259 11.0506 numMergedOcc 0
4 mol 96 unq 0 iso 0 dist 9.87414 6.21391 8.39111 4.96607 7.3964 6.16858 numMergedOcc 0
5 mol 96 unq 1 iso 0 dist 8.9536 4.86104 8.39111 8.36645 7.3964 6.16858 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 8.48678 13.9683 6.7117 13.9427 8.43352 7.32662 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 8.48678 11.0642 4.47349 13.9427 8.43352 6.934 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 8.48678 7.71768 5.65185 13.9427 8.43352 7.17433 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 9.21645 11.6494 8.00003 8.22571 7.12072 5.75886 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 9.57532 12.1367 9.23858 8.70712 7.91683 3.78311 numMergedOcc 0
11 mol 119 unq 2 iso 0 dist 8.61574 10.5726 9.23858 6.89245 7.91683 3.78311 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 6.87196 5.25879 8.78276 11.923 9.13191 13.4409 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 6.87196 5.26656 7.88805 11.923 9.13191 9.44878 numMergedOcc 0
14 mol 130 unq 2 iso 0 dist 6.87196 10.9365 7.96646 11.923 9.13191 14.206 numMergedOcc 0
15 mol 130 unq 3 iso 0 dist 6.87196 10.6181 7.90048 11.923 9.13191 4.28797 numMergedOcc 0
16 mol 131 unq 0 iso 0 dist 5.43662 5.29825 8.70296 6.3223 6.48674 7.73656 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 9.18176 5.14109 6.46461 7.65994 5.06613 5.81236 numMergedOcc 0
18 mol 156 unq 0 iso 0 dist 8.32841 10.9993 9.00416 14.911 7.46845 12.962 numMergedOcc 0
19 mol 156 unq 1 iso 0 dist 6.56065 4.75264 9.00416 11.1159 7.46845 12.962 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 9.819 15.6354 8.65535 11.802 6.37788 6.66155 numMergedOcc 0
21 mol 194 unq 1 iso 0 dist 9.819 15.6354 8.65535 12.0623 8.7028 5.4499 numMergedOcc 0
22 mol 204 unq 0 iso 0 dist 6.62013 7.24163 7.32294 6.80235 5.91727 5.74707 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 7.58118 5.1021 6.59716 6.71715 5.37796 6.17628 numMergedOcc 0
24 mol 226 unq 0 iso 0 dist 6.82883 12.6212 8.80683 7.21532 6.26945 10.142 numMergedOcc 0
25 mol 226 unq 1 iso 0 dist 6.82883 10.78 6.11704 7.21532 6.26945 6.05184 numMergedOcc 0
26 mol 226 unq 2 iso 0 dist 8.22518 9.83787 8.80683 12.0613 6.26945 10.142 numMergedOcc 0
27 mol 226 unq 3 iso 0 dist 8.22518 11.3247 6.11704 12.0613 6.26945 6.05184 numMergedOcc 0
28 mol 226 unq 4 iso 0 dist 6.02803 6.6871 8.80683 10.6196 6.26945 10.142 numMergedOcc 0
29 mol 226 unq 5 iso 0 dist 6.02803 6.19485 6.11704 10.6196 6.26945 6.05184 numMergedOcc 0
30 mol 226 unq 6 iso 0 dist 7.57964 5.13565 9.83827 7.72794 6.37744 5.96825 numMergedOcc 0
31 mol 226 unq 7 iso 0 dist 6.95495 8.19889 9.83827 7.21532 6.37744 5.96825 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 6.47859 9.78463 9.01021 5.71442 5.0804 5.66732 numMergedOcc 0
33 mol 248 unq 0 iso 0 dist 8.80866 5.44123 7.16525 9.94694 7.97135 6.71566 numMergedOcc 0
