0 mol 10 unq 0 iso 0 dist 7.47015 7.36963 3.92592 9.27837 9.85732 6.77807 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 6.02731 5.6359 4.09232 4.85685 8.21895 9.19512 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 5.86118 5.35145 5.26394 5.88789 10.0501 5.88409 numMergedOcc 0
3 mol 107 unq 0 iso 0 dist 8.92347 8.2411 3.79393 10.9097 10.5526 7.91251 numMergedOcc 0
4 mol 107 unq 1 iso 0 dist 8.92347 8.2411 3.79393 4.34186 7.89505 9.09262 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 8.97069 6.31404 13.9264 10.2525 18.8291 5.95801 numMergedOcc 0
6 mol 141 unq 1 iso 0 dist 8.97069 6.31404 13.9264 14.7938 21.816 9.92715 numMergedOcc 0
7 mol 141 unq 2 iso 0 dist 5.7251 6.31404 9.48049 10.2525 14.7944 5.95801 numMergedOcc 0
8 mol 141 unq 3 iso 0 dist 5.7251 6.31404 9.48049 14.7938 15.6957 9.92715 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 8.80059 8.65328 12.6805 4.18108 6.12453 7.0961 numMergedOcc 0
10 mol 168 unq 1 iso 0 dist 8.80059 8.65328 12.6805 3.6038 9.87447 8.26768 numMergedOcc 0
11 mol 168 unq 2 iso 0 dist 8.80059 5.69346 7.61798 4.18108 6.12453 6.53038 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.28099 5.09756 4.03697 6.14958 12.0142 9.17458 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 8.28099 5.09756 4.03697 5.87342 9.5207 7.36794 numMergedOcc 0
14 mol 186 unq 2 iso 0 dist 8.28099 7.44523 8.99937 6.14958 12.0142 6.94594 numMergedOcc 0
15 mol 186 unq 3 iso 0 dist 8.28099 7.44523 8.99937 5.87342 9.5207 5.81881 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 8.81874 9.06892 4.00869 7.61394 11.7093 9.79673 numMergedOcc 0
17 mol 222 unq 1 iso 0 dist 8.81874 9.06892 4.00869 8.54017 6.24462 6.39673 numMergedOcc 0
18 mol 222 unq 2 iso 0 dist 9.55314 8.54373 9.60662 4.7035 6.24462 7.80676 numMergedOcc 0
19 mol 222 unq 3 iso 0 dist 7.33147 8.54373 7.13962 4.7035 6.02034 7.80676 numMergedOcc 0
20 mol 260 unq 0 iso 0 dist 7.23618 7.97307 9.07649 8.90225 12.8322 8.51564 numMergedOcc 0
21 mol 260 unq 1 iso 0 dist 7.23618 8.52702 14.885 4.38276 9.24869 9.73217 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.76241 7.98589 6.64795 5.00704 10.2401 5.13533 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 7.47906 7.75982 3.80663 3.72284 8.77098 8.62266 numMergedOcc 0
24 mol 279 unq 1 iso 0 dist 8.56844 6.66483 10.1327 8.07304 15.4981 7.90632 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 5.54272 8.51266 9.83556 5.92057 11.3393 9.56933 numMergedOcc 0
