0 mol 20 unq 0 iso 0 dist 9.4759 6.44693 9.15208 6.43079 9.21476 11.8829 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.83248 9.15042 10.6711 8.11378 6.65308 14.8073 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 7.14979 9.84668 7.43519 9.64076 9.93484 8.79583 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.20839 6.27528 8.8408 11.4738 9.15136 10.3809 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 9.52282 5.09688 6.89762 9.66322 7.52622 10.0925 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 6.5114 9.78456 9.18721 8.80539 9.0075 15.4592 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 5.86949 8.62898 5.34721 9.5045 8.21863 13.5243 numMergedOcc 0
7 mol 148 unq 1 iso 0 dist 6.72591 9.7168 12.9245 4.44134 8.21863 13.2345 numMergedOcc 0
8 mol 148 unq 2 iso 0 dist 6.72591 7.38138 10.5987 4.44134 8.21863 11.7225 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 5.84971 8.6102 5.38822 9.37167 8.16324 13.514 numMergedOcc 0
10 mol 150 unq 1 iso 0 dist 6.80192 9.61132 12.8684 4.36797 8.16324 13.1531 numMergedOcc 0
11 mol 150 unq 2 iso 0 dist 6.80192 7.34423 10.4881 4.36797 8.16324 11.6056 numMergedOcc 0
12 mol 158 unq 0 iso 0 dist 6.45502 8.1504 5.16728 11.8974 9.07685 12.7405 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 6.5782 6.64164 6.43506 6.52044 7.78684 5.72735 numMergedOcc 0
14 mol 182 unq 0 iso 0 dist 7.03216 6.31492 9.72559 7.7168 9.96156 11.7478 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 8.98221 8.08787 9.13357 9.04255 7.62128 12.3788 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 9.66533 9.01896 11.3575 12.523 9.08316 18.7398 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 7.4202 7.26647 12.9384 7.35121 6.24373 13.8596 numMergedOcc 0
18 mol 261 unq 1 iso 0 dist 7.4202 7.26647 12.9384 13.4953 8.69549 20.1692 numMergedOcc 0
19 mol 261 unq 2 iso 0 dist 7.4202 7.7309 11.479 7.35121 6.24373 12.1837 numMergedOcc 0
20 mol 261 unq 3 iso 0 dist 7.4202 7.7309 11.479 13.4953 8.69549 18.2603 numMergedOcc 0
21 mol 282 unq 0 iso 0 dist 7.3389 7.70229 13.1327 13.06 8.64115 20.058 numMergedOcc 0
22 mol 282 unq 1 iso 0 dist 7.3389 7.90792 11.2762 13.06 8.64115 17.8362 numMergedOcc 0
