0 mol 39 unq 0 iso 0 dist 9.11806 8.4436 6.19326 11.639 13.9432 9.02925 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.63651 9.91882 4.39351 7.24424 7.0851 9.14809 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 8.54678 5.20528 4.32784 6.53227 8.15861 8.04853 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 8.54678 5.20528 4.32784 3.93024 10.0423 6.46549 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 9.1663 4.76028 4.49443 4.42089 9.46616 5.54226 numMergedOcc 0
5 mol 128 unq 0 iso 0 dist 8.47929 4.89256 6.06511 5.43682 12.9828 7.4442 numMergedOcc 0
6 mol 128 unq 1 iso 0 dist 9.71728 4.89256 7.34304 5.43682 13.1835 7.4442 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 8.36066 8.85675 6.01213 5.71332 11.2337 8.90588 numMergedOcc 0
8 mol 169 unq 0 iso 0 dist 8.51999 8.59976 6.07908 15.445 11.3108 7.85698 numMergedOcc 0
9 mol 169 unq 1 iso 0 dist 8.51999 8.59976 6.07908 4.8357 10.128 8.75484 numMergedOcc 0
10 mol 169 unq 2 iso 0 dist 8.51999 9.71763 5.82243 12.9917 9.75644 5.41121 numMergedOcc 0
11 mol 169 unq 3 iso 0 dist 8.51999 9.71763 5.82243 15.445 11.3108 6.35799 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.59599 6.0685 5.48326 4.59453 7.00382 8.2241 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 7.76429 6.0685 10.094 4.59453 10.974 8.2241 numMergedOcc 0
14 mol 186 unq 2 iso 0 dist 7.73733 6.0685 11.0387 4.59453 12.0394 8.2241 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 5.64116 6.79634 4.45301 7.82495 6.2669 7.13824 numMergedOcc 0
16 mol 217 unq 0 iso 0 dist 8.75987 5.88992 11.952 5.14513 10.8944 8.4493 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 6.69765 7.90349 4.47764 5.7279 10.3392 8.73715 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 8.87308 6.65465 4.37382 5.08672 10.4476 7.49502 numMergedOcc 0
19 mol 240 unq 0 iso 0 dist 5.05078 4.98994 4.43015 4.139 7.8705 7.01441 numMergedOcc 0
20 mol 240 unq 1 iso 0 dist 7.99097 4.98994 9.01165 4.139 11.6953 7.01441 numMergedOcc 0
21 mol 281 unq 0 iso 0 dist 6.76971 9.42297 13.8963 7.60311 11.6039 6.18742 numMergedOcc 0
22 mol 281 unq 1 iso 0 dist 6.76971 9.42297 13.8963 11.1675 14.2852 6.8089 numMergedOcc 0
23 mol 281 unq 2 iso 0 dist 9.68891 9.42297 13.0358 7.60311 14.4196 6.18742 numMergedOcc 0
24 mol 281 unq 3 iso 0 dist 9.68891 9.42297 13.0358 11.1675 16.551 6.8089 numMergedOcc 0
