0 mol 15 unq 0 iso 0 dist 5.19544 7.42909 6.88546 8.80394 6.03257 12.7322 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.44507 14.2845 8.98417 14.288 6.56527 7.46244 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 9.45566 11.5696 9.98746 4.83412 7.48846 7.19218 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 6.66861 8.03646 9.89804 10.042 9.93096 9.83082 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 6.72084 13.0255 9.89804 12.1572 9.93096 9.83082 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 5.51406 6.16048 6.93893 10.4949 8.66165 12.671 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 7.11127 4.24483 5.74593 9.3668 5.50508 8.27358 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 6.37888 6.18402 5.74593 4.00884 5.50508 8.27358 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 7.11438 11.011 5.74593 4.1125 5.50508 8.27358 numMergedOcc 0
9 mol 93 unq 0 iso 0 dist 7.4518 8.97237 7.8962 14.4094 8.89417 8.41572 numMergedOcc 0
10 mol 93 unq 1 iso 0 dist 7.4518 8.97237 7.8962 9.73718 9.95255 5.74733 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 8.27794 7.3536 4.86767 14.0508 8.42878 6.72133 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 7.6005 8.77017 8.03113 10.5065 8.38606 13.3662 numMergedOcc 0
13 mol 116 unq 1 iso 0 dist 7.6005 16.186 9.2638 10.5065 8.38606 10.4136 numMergedOcc 0
14 mol 116 unq 2 iso 0 dist 8.7583 7.43615 8.03113 14.2962 8.38606 13.3662 numMergedOcc 0
15 mol 116 unq 3 iso 0 dist 8.7583 17.5453 9.2638 14.2962 8.38606 10.4136 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 6.32097 10.4255 9.33514 6.5238 9.73541 15.6069 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 7.83422 9.592 9.25162 6.36084 9.8664 15.3266 numMergedOcc 0
18 mol 244 unq 0 iso 0 dist 8.08939 16.7895 9.97458 8.89726 7.95359 12.5433 numMergedOcc 0
19 mol 244 unq 1 iso 0 dist 8.08939 16.7895 9.97458 10.6799 6.22122 14.3743 numMergedOcc 0
20 mol 244 unq 2 iso 0 dist 7.33574 15.1633 9.97458 4.55034 7.95359 12.5433 numMergedOcc 0
21 mol 244 unq 3 iso 0 dist 7.33574 15.1633 9.97458 8.05133 6.22122 14.3743 numMergedOcc 0
