0 mol 15 unq 0 iso 0 dist 8.0637 4.98085 5.19544 4.89563 5.69927 5.89412 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 8.0637 4.98085 5.19544 11.9367 7.63656 7.07399 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.83402 12.1605 7.05148 9.14728 6.17631 8.6653 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 8.83402 12.1605 7.05148 8.46842 5.59268 7.92503 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 8.94991 5.85411 5.51406 14.6373 10.2967 9.30539 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.84583 7.65932 5.94696 12.9741 12.4265 6.7117 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.84583 7.65932 5.94696 11.233 7.1452 4.47349 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 5.84583 7.65932 5.94696 9.48388 4.96747 5.65185 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 6.28645 5.95402 5.37302 12.4488 14.0364 9.66219 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.34149 5.87062 6.16862 14.8418 12.7925 9.22232 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 8.63279 5.87062 9.70325 14.8418 15.4258 9.22232 numMergedOcc 0
11 mol 135 unq 0 iso 0 dist 6.1777 4.75453 5.43728 10.1401 8.13139 5.62052 numMergedOcc 0
12 mol 135 unq 1 iso 0 dist 6.1777 4.75453 5.43728 11.1218 5.88534 7.85645 numMergedOcc 0
13 mol 135 unq 2 iso 0 dist 6.29701 4.14325 5.43728 9.13451 8.13139 5.62052 numMergedOcc 0
14 mol 135 unq 3 iso 0 dist 6.29701 4.14325 5.43728 9.171 5.88534 7.85645 numMergedOcc 0
15 mol 146 unq 0 iso 0 dist 9.5348 4.50898 7.13378 8.74283 8.76758 8.84535 numMergedOcc 0
16 mol 146 unq 1 iso 0 dist 9.5348 4.50898 7.13378 12.6102 6.347 8.82188 numMergedOcc 0
17 mol 170 unq 0 iso 0 dist 9.2621 5.34021 9.53158 12.5738 8.89464 9.10511 numMergedOcc 0
18 mol 170 unq 1 iso 0 dist 9.2621 5.34021 9.53158 7.47249 7.71028 6.35982 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 6.17749 6.11074 5.89818 8.81925 4.82768 7.67576 numMergedOcc 0
20 mol 222 unq 1 iso 0 dist 6.17749 6.22277 9.32543 8.81925 4.82768 9.82371 numMergedOcc 0
21 mol 226 unq 0 iso 0 dist 9.8767 5.9053 7.04477 13.1056 10.0275 8.80683 numMergedOcc 0
22 mol 226 unq 1 iso 0 dist 9.8767 5.9053 7.04477 11.1425 5.47434 6.11704 numMergedOcc 0
23 mol 232 unq 0 iso 0 dist 8.15743 4.03628 7.83422 6.94983 9.60401 9.05071 numMergedOcc 0
