0 mol 2 unq 0 iso 0 dist 9.74371 9.97525 6.35342 14.1709 7.93028 12.2171 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.79881 5.92411 5.94778 5.29182 8.80745 5.95511 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 9.89535 5.77755 5.94778 8.16424 8.80745 5.95511 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 5.92936 7.52996 9.28253 8.57639 7.75341 14.4586 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.4438 15.6609 9.28253 4.93697 7.75341 14.4586 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.67865 5.1767 4.98104 5.99325 8.67475 4.46885 numMergedOcc 0
6 mol 104 unq 0 iso 0 dist 5.90762 7.86595 9.22466 7.87695 8.73137 5.80827 numMergedOcc 0
7 mol 178 unq 0 iso 0 dist 8.14441 13.6129 8.0974 7.91652 7.97 9.4452 numMergedOcc 0
8 mol 178 unq 1 iso 0 dist 8.14441 13.6129 8.0974 11.8474 6.95432 6.42973 numMergedOcc 0
9 mol 178 unq 2 iso 0 dist 8.14441 13.6129 8.0974 5.71 9.32853 10.8373 numMergedOcc 0
10 mol 183 unq 0 iso 0 dist 6.21267 11.4393 7.31181 5.49911 8.41645 12.5823 numMergedOcc 0
11 mol 183 unq 1 iso 0 dist 7.41743 6.81609 7.31181 10.5387 8.41645 12.5823 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 8.51118 8.58314 8.64255 7.01801 8.18029 9.80333 numMergedOcc 0
13 mol 198 unq 0 iso 0 dist 4.58291 4.81051 6.47339 6.35535 9.12973 8.80161 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 8.63033 12.1408 9.72979 4.61338 5.83021 7.89575 numMergedOcc 0
15 mol 206 unq 1 iso 0 dist 8.63033 9.19627 6.97859 4.61338 5.83021 5.14674 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 6.24111 13.3929 9.67457 7.28395 9.11574 13.1851 numMergedOcc 0
17 mol 210 unq 1 iso 0 dist 9.00343 12.3088 9.67457 7.49477 9.11574 13.1851 numMergedOcc 0
18 mol 210 unq 2 iso 0 dist 6.41444 13.3774 9.67457 4.78349 9.11574 13.1851 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 7.57712 6.19375 7.31105 7.47274 7.27248 9.9903 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 7.62593 11.4653 9.33771 11.5075 8.96784 5.72475 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 7.62593 12.5358 7.39839 11.5075 8.96784 4.7981 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 7.99218 10.3775 7.2346 7.41522 4.36956 4.21867 numMergedOcc 0
23 mol 235 unq 1 iso 0 dist 7.99218 10.3775 7.2346 6.179 8.43799 5.88852 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 5.57184 9.76195 6.83152 5.36582 8.28643 10.1427 numMergedOcc 0
25 mol 238 unq 1 iso 0 dist 5.57184 7.01206 5.24313 5.36582 8.28643 5.71717 numMergedOcc 0
26 mol 248 unq 0 iso 0 dist 8.11968 9.48478 8.71859 9.33595 7.90773 4.58289 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 6.23539 6.13402 8.57532 5.38166 8.18813 10.9833 numMergedOcc 0
28 mol 277 unq 1 iso 0 dist 6.23539 6.16829 9.02914 5.38166 8.18813 4.40029 numMergedOcc 0
29 mol 277 unq 2 iso 0 dist 6.23539 7.44724 6.90434 5.38166 8.18813 3.97543 numMergedOcc 0
30 mol 283 unq 0 iso 0 dist 7.53773 4.69801 9.53225 5.60193 9.4181 7.83976 numMergedOcc 0
