0 mol 25 unq 0 iso 0 dist 7.0928 11.7801 8.87757 10.2544 4.69295 9.16515 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 7.0928 11.7801 8.87757 10.7389 8.79309 9.82987 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 7.0928 11.7801 8.87757 16.1554 14.9206 9.40732 numMergedOcc 0
3 mol 25 unq 3 iso 0 dist 7.0928 11.7801 8.87757 15.1167 13.6145 6.53269 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 7.47827 3.98211 9.30539 12.0315 12.6799 8.77355 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 8.14071 6.95825 4.97175 7.11486 6.16616 9.35533 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 9.75558 9.62363 9.97343 11.6751 13.4066 6.65731 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 8.72463 16.1752 7.78652 13.0453 4.78563 5.06564 numMergedOcc 0
8 mol 143 unq 1 iso 0 dist 8.72463 17.1567 8.91301 13.0453 4.78563 7.5373 numMergedOcc 0
9 mol 155 unq 0 iso 0 dist 8.14907 7.76857 6.53347 11.7291 7.10286 9.24038 numMergedOcc 0
10 mol 159 unq 0 iso 0 dist 7.78695 11.6088 8.4858 9.36133 4.48323 9.35202 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 6.07676 6.28923 6.46704 11.4537 6.28125 9.06571 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 6.07676 6.28923 6.46704 11.3229 6.50233 7.35884 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 6.07676 6.10683 6.59025 11.4537 6.28125 9.88897 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 6.96824 4.75774 5.9176 12.8233 10.6474 8.12266 numMergedOcc 0
15 mol 181 unq 4 iso 0 dist 6.96824 4.75774 5.9176 11.8965 5.12833 9.43306 numMergedOcc 0
16 mol 181 unq 5 iso 0 dist 6.96824 4.75774 5.9176 9.21837 4.61184 8.59681 numMergedOcc 0
17 mol 181 unq 6 iso 0 dist 6.96824 9.91956 6.41453 12.496 5.93724 5.99437 numMergedOcc 0
18 mol 181 unq 7 iso 0 dist 6.96824 9.91956 6.41453 11.8965 5.12833 8.4848 numMergedOcc 0
19 mol 182 unq 0 iso 0 dist 6.31492 7.00671 6.73956 8.45614 4.88992 8.62102 numMergedOcc 0
20 mol 182 unq 1 iso 0 dist 7.8621 9.23913 6.73956 12.5016 4.88992 8.62102 numMergedOcc 0
21 mol 231 unq 0 iso 0 dist 8.17766 6.62976 7.79066 11.3576 4.15084 9.60504 numMergedOcc 0
22 mol 231 unq 1 iso 0 dist 9.84965 5.74327 7.79066 10.0413 4.15084 9.60504 numMergedOcc 0
