0 mol 11 unq 0 iso 0 dist 9.76233 11.8533 6.83186 12.729 3.66215 5.25331 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 7.32472 4.61111 4.75881 9.87396 3.76025 7.4403 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 7.32472 4.61111 4.75881 8.23162 8.50202 8.61815 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.26805 6.27527 7.66068 14.2999 10.865 8.90522 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 9.68577 6.27527 9.5043 14.2999 10.2651 8.90522 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 6.38269 10.3632 4.49669 7.77845 5.09579 5.45882 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 6.38269 9.86085 6.00221 7.77845 5.09579 4.57487 numMergedOcc 0
7 mol 113 unq 2 iso 0 dist 7.11196 10.3632 5.88896 7.77845 5.46299 5.45882 numMergedOcc 0
8 mol 123 unq 0 iso 0 dist 7.49032 11.4019 8.03692 19.0999 14.0485 8.53618 numMergedOcc 0
9 mol 123 unq 1 iso 0 dist 7.04627 8.90549 8.03692 16.0671 14.0485 8.53618 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 6.91039 4.62104 4.3855 11.011 4.19541 8.08798 numMergedOcc 0
11 mol 176 unq 0 iso 0 dist 6.32254 5.25264 6.85902 6.47176 6.33976 9.67312 numMergedOcc 0
12 mol 176 unq 1 iso 0 dist 8.89556 3.97245 6.85902 8.92131 6.33976 9.67312 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 7.22151 3.64687 9.54529 9.16822 8.74865 8.9632 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 7.22473 7.91474 8.62655 15.3103 11.4575 8.8385 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 7.13397 4.38276 8.62655 9.00987 11.4575 8.8385 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 6.9943 4.58167 6.96692 13.3 16.2268 9.6721 numMergedOcc 0
17 mol 266 unq 1 iso 0 dist 7.36685 4.58167 8.25286 13.3 16.7453 9.6721 numMergedOcc 0
18 mol 266 unq 2 iso 0 dist 9.20906 16.8584 9.9965 21.979 17.4207 9.6721 numMergedOcc 0
19 mol 266 unq 3 iso 0 dist 9.03099 4.58167 9.9965 13.3 17.4207 9.6721 numMergedOcc 0
