0 mol 0 unq 0 iso 0 dist 9.94618 9.83355 19.2476 5.47921 15.3785 6.26831 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.94618 8.88219 9.53313 7.49611 12.4363 9.56794 numMergedOcc 0
2 mol 6 unq 0 iso 0 dist 8.8273 9.71239 9.88888 5.44352 9.92542 8.41731 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 9.49909 9.01516 13.124 14.3481 18.7416 8.63486 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.53504 8.0534 10.565 4.91508 11.1478 8.03303 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.66342 8.0534 10.0209 4.91508 9.75201 8.03303 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 7.21285 8.0534 6.28525 4.91508 9.02288 8.03303 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 6.95094 8.0534 5.32605 4.91508 9.58544 8.03303 numMergedOcc 0
8 mol 75 unq 0 iso 0 dist 8.47302 5.50645 7.01551 6.88558 14.1169 7.9233 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 9.36989 9.67735 12.2525 10.602 17.1311 7.32289 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 8.6728 9.67735 7.44829 10.602 7.38759 7.32289 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 8.592 6.07991 10.9798 9.52181 8.42445 6.34525 numMergedOcc 0
12 mol 126 unq 0 iso 0 dist 9.40608 9.31118 12.3511 5.50061 9.54928 9.46588 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 6.89564 6.39075 5.45144 5.90361 10.6589 8.56003 numMergedOcc 0
14 mol 170 unq 0 iso 0 dist 5.94075 5.59924 4.77713 7.62198 11.2959 8.15099 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 9.59797 9.85967 13.6418 15.1894 21.6347 9.11712 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.09373 5.31166 8.13761 5.95114 13.726 9.56197 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 8.09373 5.31166 8.13761 5.93294 10.8081 7.24795 numMergedOcc 0
18 mol 186 unq 2 iso 0 dist 8.09373 5.31166 8.13761 8.88219 13.2605 8.64409 numMergedOcc 0
19 mol 186 unq 3 iso 0 dist 8.09373 5.31166 8.13761 7.74823 14.7602 7.60202 numMergedOcc 0
20 mol 186 unq 4 iso 0 dist 8.40343 6.58421 6.46459 5.77884 11.1735 7.20574 numMergedOcc 0
21 mol 186 unq 5 iso 0 dist 8.40343 6.58421 6.46459 7.02436 12.6312 6.85302 numMergedOcc 0
22 mol 203 unq 0 iso 0 dist 8.8589 6.97422 10.6706 11.7852 17.8478 8.72527 numMergedOcc 0
23 mol 209 unq 0 iso 0 dist 8.65539 9.93982 11.3106 9.80484 14.3923 8.41195 numMergedOcc 0
24 mol 209 unq 1 iso 0 dist 7.757 9.9518 9.44664 11.2558 15.6294 8.41195 numMergedOcc 0
25 mol 214 unq 0 iso 0 dist 5.69733 7.30003 5.20422 5.68711 8.49704 6.38157 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 7.24089 8.9766 12.8903 5.56999 6.00877 7.4099 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 7.98871 9.06496 7.01469 7.0797 9.98528 6.57903 numMergedOcc 0
28 mol 277 unq 1 iso 0 dist 7.98871 9.06496 7.01469 7.32232 13.1975 9.65707 numMergedOcc 0
29 mol 279 unq 0 iso 0 dist 7.88102 7.84195 15.0876 11.4893 15.8005 8.29305 numMergedOcc 0
30 mol 279 unq 1 iso 0 dist 7.88102 7.84195 15.0876 12.9462 19.5747 6.43341 numMergedOcc 0
31 mol 279 unq 2 iso 0 dist 7.93694 7.84195 13.7974 11.4893 15.7136 8.29305 numMergedOcc 0
32 mol 279 unq 3 iso 0 dist 7.93694 7.84195 13.7974 12.9462 19.0919 6.43341 numMergedOcc 0
