0 mol 1 unq 0 iso 0 dist 9.60615 8.5245 7.27254 11.91 6.27888 8.26708 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.60615 8.5245 7.27254 12.2244 4.50502 6.09918 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 7.54282 9.77186 6.38243 9.61029 7.11305 8.44506 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 5.19462 7.56926 7.24352 14.9909 10.8828 9.93832 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 5.19462 7.56926 7.24352 9.16827 5.07458 8.60739 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 8.4185 13.3842 5.07125 10.7264 6.15355 8.63486 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 4.88863 5.6194 9.45329 6.6606 5.74372 7.9814 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 8.2282 13.515 9.45329 13.3191 5.74372 7.9814 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 9.29692 17.2555 8.75597 10.6124 3.9764 7.26086 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 8.71558 12.4403 8.75597 10.671 3.9764 7.26086 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 7.79263 6.0453 9.6121 10.5727 6.9194 7.77116 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 9.9292 11.298 9.57341 15.0885 9.68677 7.77116 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 7.09831 11.5038 9.05336 12.8081 6.11469 8.56003 numMergedOcc 0
13 mol 159 unq 0 iso 0 dist 9.36133 6.47213 6.07821 7.78695 4.48323 7.25742 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 8.83844 13.6277 8.999 12.0932 4.00127 9.11712 numMergedOcc 0
15 mol 171 unq 1 iso 0 dist 5.57333 5.9285 9.13027 10.4371 11.8244 7.71426 numMergedOcc 0
16 mol 171 unq 2 iso 0 dist 5.57333 5.9285 9.13027 10.51 13.9189 5.10618 numMergedOcc 0
17 mol 171 unq 3 iso 0 dist 5.57333 5.9285 9.13027 10.8952 8.25926 9.86681 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.43325 5.26093 6.07389 10.5412 15.0914 9.83476 numMergedOcc 0
19 mol 196 unq 0 iso 0 dist 8.58805 11.9967 6.25813 6.64506 6.29158 8.20691 numMergedOcc 0
20 mol 198 unq 0 iso 0 dist 8.37455 11.1573 8.12201 16.8042 10.1469 9.18635 numMergedOcc 0
21 mol 198 unq 1 iso 0 dist 8.37455 11.1573 8.12201 5.80867 6.0599 8.10985 numMergedOcc 0
22 mol 198 unq 2 iso 0 dist 8.17562 4.75457 8.12201 12.9579 10.1469 9.18635 numMergedOcc 0
23 mol 198 unq 3 iso 0 dist 8.17562 4.75457 8.12201 9.4363 6.0599 8.10985 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 7.17095 7.45292 7.97027 14.2695 9.01393 9.2581 numMergedOcc 0
25 mol 222 unq 1 iso 0 dist 7.17095 7.45292 7.97027 15.8305 13.3586 9.62632 numMergedOcc 0
26 mol 222 unq 2 iso 0 dist 7.17095 7.45292 7.97027 10.8642 8.84507 7.862 numMergedOcc 0
27 mol 251 unq 0 iso 0 dist 6.96393 9.31166 6.42747 11.6355 4.86046 8.01198 numMergedOcc 0
