0 mol 10 unq 0 iso 0 dist 7.57901 5.02729 5.59965 9.8934 3.92592 6.18431 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 7.57901 5.02729 5.59965 11.5527 5.53712 9.07726 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.01993 11.194 7.35861 14.4485 6.64374 9.96912 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 4.9737 6.09666 6.93197 11.6641 10.1622 6.07276 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.69823 12.6813 8.19993 16.6249 9.12073 6.07052 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.21813 6.3915 7.36769 5.91797 3.92737 9.25444 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.21813 6.3915 7.36769 6.37954 3.94967 9.84703 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 5.21813 5.081 6.88901 5.91797 3.92737 8.46823 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 5.21813 5.081 6.88901 6.37954 3.94967 4.62494 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 7.89276 11.0602 7.36769 9.93764 3.92737 9.25444 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 7.89276 11.0602 7.36769 10.0215 3.94967 9.84703 numMergedOcc 0
11 mol 98 unq 6 iso 0 dist 7.89276 14.1992 6.88901 9.93764 3.92737 8.46823 numMergedOcc 0
12 mol 98 unq 7 iso 0 dist 7.89276 14.1992 6.88901 10.0215 3.94967 4.62494 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 9.86487 11.57 7.80873 10.281 10.4943 9.26353 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 9.35946 7.07473 6.40575 13.1844 15.0575 9.0176 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 6.10556 4.96213 6.83404 5.05627 3.98068 6.65731 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 6.02094 4.80772 5.94379 11.0661 9.56782 9.88897 numMergedOcc 0
17 mol 184 unq 0 iso 0 dist 6.71675 11.5379 7.54099 8.09403 4.67256 7.58375 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 7.51337 7.6183 8.37739 11.8377 5.8463 9.82043 numMergedOcc 0
19 mol 225 unq 1 iso 0 dist 7.51337 11.0788 9.47237 11.8377 5.8463 8.22922 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 8.08581 5.86896 6.94789 11.1476 14.2323 7.39085 numMergedOcc 0
21 mol 235 unq 1 iso 0 dist 5.98104 4.88651 6.94789 10.0929 14.2323 7.39085 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 7.64361 9.95264 8.20644 18.31 16.0346 9.26157 numMergedOcc 0
