0 mol 20 unq 0 iso 0 dist 4.15066 7.9193 9.60039 4.90352 7.11633 5.30679 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 6.14782 10.5613 8.18252 9.62604 4.50572 11.8887 numMergedOcc 0
2 mol 110 unq 0 iso 0 dist 7.25891 6.0128 6.34794 4.31022 7.09405 4.98189 numMergedOcc 0
3 mol 173 unq 0 iso 0 dist 8.91036 9.62833 9.9855 9.63894 8.1088 8.01577 numMergedOcc 0
4 mol 180 unq 0 iso 0 dist 5.78414 9.57014 9.19555 5.31 5.80441 6.93557 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 5.39622 3.77738 8.52322 5.01462 8.96988 6.94867 numMergedOcc 0
6 mol 212 unq 0 iso 0 dist 7.35349 5.09611 9.74234 10.1617 8.062 9.83647 numMergedOcc 0
7 mol 229 unq 0 iso 0 dist 8.17234 15.8841 9.33775 12.61 8.6537 10.8091 numMergedOcc 0
8 mol 229 unq 1 iso 0 dist 8.17234 15.8841 9.33775 12.7466 8.75374 7.3983 numMergedOcc 0
9 mol 229 unq 2 iso 0 dist 8.17234 15.8841 9.33775 11.0366 7.10634 5.87361 numMergedOcc 0
10 mol 229 unq 3 iso 0 dist 8.17234 15.8841 9.33775 6.23286 5.57702 10.9466 numMergedOcc 0
11 mol 232 unq 0 iso 0 dist 8.15743 6.92292 8.21479 9.88635 7.70279 8.14537 numMergedOcc 0
12 mol 232 unq 1 iso 0 dist 8.15743 6.92292 8.21479 5.08111 9.29752 6.1648 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 9.77491 10.1351 9.18345 6.2683 6.24928 5.33697 numMergedOcc 0
