0 mol 2 unq 0 iso 0 dist 7.64304 3.89238 8.80146 5.92719 6.80293 6.61168 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.72502 5.11636 8.24948 6.07553 7.43716 8.21811 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.72502 5.11636 8.24948 6.48457 6.79243 5.13078 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.44506 7.11305 6.38243 12.7695 5.22495 8.13863 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 8.63486 6.15355 5.07125 12.8046 12.0116 9.52578 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 6.61823 4.3481 6.9223 12.5352 12.323 8.806 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 6.49956 4.3481 7.0561 12.5352 15.2237 8.806 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 7.77116 9.68677 9.57341 11.8946 8.58511 4.22806 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 7.36779 10.092 6.99345 10.3467 10.5101 5.35285 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 7.36779 4.46337 5.11043 10.3467 10.5101 6.71328 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 8.20836 12.8086 6.99345 13.0397 10.5101 5.35285 numMergedOcc 0
11 mol 134 unq 3 iso 0 dist 8.20836 7.41373 5.11043 13.0397 10.5101 6.71328 numMergedOcc 0
12 mol 158 unq 0 iso 0 dist 7.88319 13.7172 6.11331 9.74081 5.45107 9.16332 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 7.63018 11.3763 9.14831 5.62219 5.64437 8.96211 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 8.87609 17.3148 9.87668 20.6855 11.8248 9.12682 numMergedOcc 0
15 mol 225 unq 1 iso 0 dist 8.87609 3.97158 7.8744 11.3048 9.7379 9.16901 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 8.03442 5.0317 9.43618 9.68793 15.8396 8.60053 numMergedOcc 0
17 mol 229 unq 0 iso 0 dist 8.92743 11.0437 6.42694 13.6805 4.77424 8.34954 numMergedOcc 0
18 mol 229 unq 1 iso 0 dist 8.92743 11.9989 7.63917 13.6805 4.77424 9.27328 numMergedOcc 0
19 mol 229 unq 2 iso 0 dist 8.08082 5.66641 6.42694 12.0766 4.77424 8.34954 numMergedOcc 0
20 mol 229 unq 3 iso 0 dist 8.08082 7.4175 7.63917 12.0766 4.77424 9.27328 numMergedOcc 0
21 mol 229 unq 4 iso 0 dist 5.77318 7.46815 6.42694 9.68456 4.77424 8.34954 numMergedOcc 0
22 mol 229 unq 5 iso 0 dist 5.77318 5.37687 7.63917 9.68456 4.77424 9.27328 numMergedOcc 0
23 mol 229 unq 6 iso 0 dist 8.19603 6.62766 6.42694 6.51465 4.77424 8.34954 numMergedOcc 0
24 mol 229 unq 7 iso 0 dist 8.19603 6.03803 7.63917 6.51465 4.77424 9.27328 numMergedOcc 0
25 mol 252 unq 0 iso 0 dist 6.11473 5.6214 9.39658 10.5963 13.2367 9.03266 numMergedOcc 0
26 mol 252 unq 1 iso 0 dist 6.53679 5.6214 5.9974 10.5963 7.10224 9.03266 numMergedOcc 0
27 mol 252 unq 2 iso 0 dist 7.50201 7.40852 5.9974 6.38733 7.10224 9.03266 numMergedOcc 0
