0 mol 0 unq 0 iso 0 dist 6.80636 9.15248 8.31596 10.4388 4.62412 7.92928 10.5071 10.5603 7.02374 9.19007 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.80636 9.15248 8.31596 16.0765 12.5081 7.48645 18.4742 15.944 10.3034 6.26831 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 9.23213 10.3034 6.3267 12.412 5.96303 7.92928 9.78068 10.4406 7.02374 9.19007 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 8.33604 4.85329 6.26865 7.3915 11.705 9.07858 12.4076 17.5554 15.4959 6.82379 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 8.33604 4.85329 6.26865 7.3915 11.705 9.07858 9.22548 16.3913 12.0818 6.24978 numMergedOcc 0
5 mol 8 unq 2 iso 0 dist 8.33604 4.85329 6.26865 7.3915 11.705 9.07858 7.96511 16.2553 11.4738 9.66439 numMergedOcc 0
6 mol 9 unq 0 iso 0 dist 8.47421 11.4878 7.2199 8.83269 6.81435 9.82483 9.76038 12.7944 13.5628 7.05346 numMergedOcc 0
7 mol 94 unq 0 iso 0 dist 8.3586 10.0455 7.38914 10.5455 5.64735 5.18655 11.9894 12.5865 8.20144 8.16733 numMergedOcc 0
8 mol 94 unq 1 iso 0 dist 8.3586 10.0455 7.38914 10.5455 5.64735 5.18655 9.21829 12.0145 11.997 9.97569 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 6.73814 12.1324 9.86739 14.3116 8.36453 8.06525 14.154 10.6048 5.31367 6.34525 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 9.8589 11.0415 4.79852 12.6297 5.95187 7.01126 19.6867 11.8821 11.1651 7.35824 numMergedOcc 0
11 mol 175 unq 1 iso 0 dist 9.8589 11.0415 4.79852 15.2721 5.46129 6.58434 19.6867 11.8821 11.1651 9.17364 numMergedOcc 0
12 mol 175 unq 2 iso 0 dist 7.24908 5.0384 4.79852 10.1905 5.95187 7.01126 15.5713 11.8821 11.1651 7.35824 numMergedOcc 0
13 mol 175 unq 3 iso 0 dist 7.24908 5.0384 4.79852 11.1503 5.46129 6.58434 15.5713 11.8821 11.1651 9.17364 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 8.53199 7.47048 6.75035 5.76954 8.21424 6.61099 4.72474 12.0819 8.36122 6.29367 numMergedOcc 0
15 mol 218 unq 1 iso 0 dist 8.53199 7.47048 6.75035 5.76954 8.21424 6.61099 5.61978 13.6555 12.7963 9.20961 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 5.50387 10.7506 8.75834 11.5332 7.15437 5.13453 13.3965 9.88956 8.69249 6.6561 numMergedOcc 0
17 mol 225 unq 1 iso 0 dist 5.50387 10.7506 8.75834 15.6311 15.2958 7.95883 14.9215 16.1377 9.60485 9.18895 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 9.62609 8.8709 6.152 5.4694 5.23507 7.89801 5.22356 13.4493 13.3557 8.38865 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 8.17891 13.3557 7.95168 8.38865 5.92529 7.89801 5.22356 6.95902 8.8709 5.4694 numMergedOcc 0
20 mol 227 unq 2 iso 0 dist 6.95902 8.8709 7.95168 5.4694 5.92529 7.89801 5.22356 8.17891 13.3557 8.38865 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 7.20082 6.26168 6.34801 10.2163 10.151 7.18771 14.7505 15.8437 10.0774 8.67805 numMergedOcc 0
