0 mol 7 unq 0 iso 0 dist 8.71567 9.8592 7.05375 6.94615 11.1529 8.88491 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.71567 9.8592 7.05375 9.17764 16.8492 17.6307 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 9.28339 5.27589 4.80464 8.90496 13.4438 10.3127 numMergedOcc 0
3 mol 21 unq 1 iso 0 dist 8.97549 5.27589 6.91363 8.90496 6.50188 10.3127 numMergedOcc 0
4 mol 21 unq 2 iso 0 dist 8.32279 5.27589 12.1396 8.90496 7.9574 10.3127 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 8.79578 7.32436 5.64505 9.46449 7.03665 7.13002 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 4.86511 9.26484 10.8346 5.76805 6.60748 5.75083 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 5.39344 9.23755 12.1862 8.64736 13.8643 10.9054 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 7.45209 5.84349 7.82029 8.4204 5.04455 9.61054 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.33187 6.7402 7.04877 7.85849 6.31506 10.8471 numMergedOcc 0
10 mol 189 unq 0 iso 0 dist 7.35054 9.36549 5.92167 9.6509 4.64514 6.37312 numMergedOcc 0
11 mol 189 unq 1 iso 0 dist 7.35054 6.77351 6.65176 9.6509 4.64514 6.41248 numMergedOcc 0
12 mol 189 unq 2 iso 0 dist 8.77488 8.4676 6.65176 9.31137 8.35563 13.375 numMergedOcc 0
13 mol 189 unq 3 iso 0 dist 9.23084 8.4676 6.48123 9.31137 15.6895 13.375 numMergedOcc 0
14 mol 195 unq 0 iso 0 dist 8.28543 8.3941 4.71117 5.0778 7.18246 8.18632 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 5.28576 8.64849 4.04412 8.31751 6.62409 9.77425 numMergedOcc 0
16 mol 226 unq 1 iso 0 dist 5.28576 6.3687 4.09525 9.84017 5.92063 8.87365 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 6.00139 9.41633 5.91498 9.39578 9.7952 15.6765 numMergedOcc 0
