0 mol 21 unq 0 iso 0 dist 8.58489 4.80464 6.97295 9.3844 9.29842 9.3814 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 6.62176 5.24476 6.57773 11.935 8.74231 7.43519 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 6.74134 5.09183 8.09587 10.5571 9.79714 13.0619 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 8.09741 7.71069 8.60438 6.75623 8.14057 9.18603 numMergedOcc 0
4 mol 158 unq 0 iso 0 dist 8.99498 7.12637 6.06276 8.85644 8.45117 8.38978 numMergedOcc 0
5 mol 158 unq 1 iso 0 dist 8.95898 11.9599 6.06276 5.6787 8.45117 8.38978 numMergedOcc 0
6 mol 182 unq 0 iso 0 dist 5.31957 4.8128 7.67974 5.4214 7.21035 4.85077 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 5.97162 6.78172 7.17789 9.40374 5.47189 12.5982 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 8.01913 8.2129 9.66105 7.2801 6.9028 8.22716 numMergedOcc 0
9 mol 220 unq 1 iso 0 dist 8.01913 6.4634 9.64006 7.2801 6.9028 9.18635 numMergedOcc 0
10 mol 228 unq 0 iso 0 dist 7.4244 10.0549 9.21065 4.91976 8.89311 8.07826 numMergedOcc 0
11 mol 228 unq 1 iso 0 dist 7.40089 5.67892 9.23333 4.96692 8.81885 7.8494 numMergedOcc 0
12 mol 228 unq 2 iso 0 dist 7.19441 9.76534 9.23333 5.06474 8.81885 7.8494 numMergedOcc 0
13 mol 228 unq 3 iso 0 dist 7.21082 5.95601 9.21065 4.70843 8.89311 8.07826 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 6.09111 6.13888 8.41604 6.54297 9.39439 7.92104 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 6.35418 7.55924 6.25412 6.37876 9.85618 10.1651 numMergedOcc 0
16 mol 257 unq 0 iso 0 dist 6.19814 12.4175 9.91996 7.16436 5.16581 5.54149 numMergedOcc 0
17 mol 257 unq 1 iso 0 dist 6.19814 12.4175 9.91996 5.85328 5.13633 10.8918 numMergedOcc 0
18 mol 271 unq 0 iso 0 dist 6.67008 10.9694 7.90629 6.00331 7.59727 7.30308 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 8.33893 7.42626 4.86518 11.2037 8.62414 4.7203 numMergedOcc 0
20 mol 278 unq 1 iso 0 dist 8.33893 7.42626 4.86518 12.6489 6.23184 6.42903 numMergedOcc 0
21 mol 294 unq 0 iso 0 dist 8.79534 11.231 7.15278 9.13951 5.71661 6.99988 numMergedOcc 0
22 mol 294 unq 1 iso 0 dist 8.79534 11.231 7.15278 10.409 8.98536 11.8346 numMergedOcc 0
23 mol 294 unq 2 iso 0 dist 6.18078 6.66087 8.92737 9.48026 6.45955 6.99988 numMergedOcc 0
24 mol 294 unq 3 iso 0 dist 6.18078 6.66087 8.92737 13.5893 8.86937 11.8346 numMergedOcc 0
25 mol 294 unq 4 iso 0 dist 6.78706 6.66087 7.15278 9.48026 5.71661 6.99988 numMergedOcc 0
26 mol 294 unq 5 iso 0 dist 6.78706 6.66087 7.15278 13.5893 8.98536 11.8346 numMergedOcc 0
