0 mol 79 unq 0 iso 0 dist 6.29267 9.64361 9.02602 9.878 7.90338 16.7311 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 6.56288 5.97559 2.58673 12.0467 5.61151 6.54289 numMergedOcc 0
2 mol 85 unq 1 iso 0 dist 5.97559 6.56288 2.58673 12.0467 6.54289 5.61151 numMergedOcc 0
3 mol 85 unq 2 iso 0 dist 5.97559 6.56288 2.58673 11.8012 7.52869 9.18895 numMergedOcc 0
4 mol 85 unq 3 iso 0 dist 5.97559 6.56288 2.58673 12.0763 9.18945 9.58605 numMergedOcc 0
5 mol 111 unq 0 iso 0 dist 5.53271 8.51084 8.72808 4.10604 7.75479 12.2574 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 8.42277 6.26653 3.11116 8.8704 8.86956 9.77106 numMergedOcc 0
7 mol 176 unq 0 iso 0 dist 8.00223 9.60695 4.75543 9.87769 9.67312 14.2349 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 7.42696 5.86468 11.7423 5.83778 8.19749 10.9651 numMergedOcc 0
9 mol 184 unq 1 iso 0 dist 7.42696 8.73302 9.91264 5.83778 8.19749 10.7379 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 7.15344 9.60981 8.15958 4.22625 7.76863 10.4588 numMergedOcc 0
11 mol 204 unq 1 iso 0 dist 7.15344 9.98617 2.95898 4.22625 7.76863 10.2353 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 8.13391 8.4285 3.62594 6.91503 6.07371 7.98532 numMergedOcc 0
13 mol 212 unq 1 iso 0 dist 8.4285 8.13391 3.62594 6.91503 7.98532 6.07371 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 5.79883 7.45508 12.7924 7.2107 6.16848 12.0365 numMergedOcc 0
15 mol 264 unq 0 iso 0 dist 6.67548 5.57579 2.95376 6.08436 8.56867 6.29872 numMergedOcc 0
16 mol 264 unq 1 iso 0 dist 5.57579 6.67548 2.95376 6.08436 6.29872 8.56867 numMergedOcc 0
17 mol 294 unq 0 iso 0 dist 8.81999 4.83062 11.8335 4.83248 9.33755 6.25334 numMergedOcc 0
18 mol 294 unq 1 iso 0 dist 8.81999 5.18334 12.3466 4.83248 9.33755 9.24869 numMergedOcc 0
19 mol 294 unq 2 iso 0 dist 4.83062 8.81999 11.8335 4.83248 6.25334 9.33755 numMergedOcc 0
20 mol 294 unq 3 iso 0 dist 4.83062 5.18334 4.59062 4.83248 6.25334 9.24869 numMergedOcc 0
21 mol 294 unq 4 iso 0 dist 8.65363 6.44588 4.59062 9.56783 6.25334 9.24869 numMergedOcc 0
