0 mol 7 unq 0 iso 0 dist 6.66645 10.84 9.55056 6.58295 7.45262 6.57017 numMergedOcc 0
1 mol 7 unq 0 iso 1 dist 6.66645 6.58295 7.45262 10.84 9.55056 6.57017 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 5.22017 10.84 7.57354 6.58295 6.96586 6.57017 numMergedOcc 0
3 mol 7 unq 1 iso 1 dist 5.22017 6.58295 6.96586 10.84 7.57354 6.57017 numMergedOcc 0
4 mol 8 unq 0 iso 0 dist 7.70793 7.55301 8.94096 5.95206 9.07858 11.3346 numMergedOcc 0
5 mol 8 unq 0 iso 1 dist 7.70793 5.95206 9.07858 7.55301 8.94096 11.3346 numMergedOcc 0
6 mol 13 unq 0 iso 0 dist 7.56303 10.6468 8.00865 6.28453 9.11447 9.40499 numMergedOcc 0
7 mol 13 unq 0 iso 1 dist 7.56303 6.28453 9.11447 10.6468 8.00865 9.40499 numMergedOcc 0
8 mol 34 unq 0 iso 0 dist 8.64844 6.97983 6.93364 10.4068 6.34821 4.72138 numMergedOcc 0
9 mol 34 unq 0 iso 1 dist 8.64844 10.4068 6.34821 6.97983 6.93364 4.72138 numMergedOcc 0
10 mol 39 unq 0 iso 0 dist 6.50983 5.70213 8.19733 11.2297 8.57165 15.4102 numMergedOcc 0
11 mol 39 unq 0 iso 1 dist 6.50983 11.2297 8.57165 5.70213 8.19733 15.4102 numMergedOcc 0
12 mol 44 unq 0 iso 0 dist 5.06773 7.91356 9.17518 3.92405 8.21833 6.81119 numMergedOcc 0
13 mol 44 unq 0 iso 1 dist 5.06773 3.92405 8.21833 7.91356 9.17518 6.81119 numMergedOcc 0
14 mol 44 unq 1 iso 0 dist 8.2444 13.347 9.17518 7.61459 8.21833 6.81119 numMergedOcc 0
15 mol 44 unq 1 iso 1 dist 8.2444 7.61459 8.21833 13.347 9.17518 6.81119 numMergedOcc 0
16 mol 69 unq 0 iso 0 dist 9.4079 18.6094 9.52877 9.30326 8.82738 14.4772 numMergedOcc 0
17 mol 69 unq 0 iso 1 dist 9.4079 9.30326 8.82738 18.6094 9.52877 14.4772 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 9.2746 11.3281 9.87025 6.21945 5.85818 8.58342 numMergedOcc 0
19 mol 119 unq 0 iso 1 dist 9.2746 6.21945 5.85818 11.3281 9.87025 8.58342 numMergedOcc 0
20 mol 154 unq 0 iso 0 dist 7.77159 10.0825 9.47362 11.0324 6.28417 15.1287 numMergedOcc 0
21 mol 154 unq 0 iso 1 dist 7.77159 11.0324 6.28417 10.0825 9.47362 15.1287 numMergedOcc 0
22 mol 156 unq 0 iso 0 dist 8.63783 7.00982 6.87906 9.50607 8.49473 6.29254 numMergedOcc 0
23 mol 156 unq 0 iso 1 dist 8.63783 9.50607 8.49473 7.00982 6.87906 6.29254 numMergedOcc 0
24 mol 156 unq 1 iso 0 dist 8.63783 7.00982 6.87906 7.69314 7.94975 8.88109 numMergedOcc 0
25 mol 156 unq 1 iso 1 dist 8.63783 7.69314 7.94975 7.00982 6.87906 8.88109 numMergedOcc 0
26 mol 156 unq 2 iso 0 dist 8.63783 7.00982 6.87906 16.0317 9.39865 11.878 numMergedOcc 0
27 mol 156 unq 2 iso 1 dist 8.63783 16.0317 9.39865 7.00982 6.87906 11.878 numMergedOcc 0
28 mol 156 unq 1 iso 0 dist 8.63783 9.50607 8.49473 7.69314 7.94975 13.8529 numMergedOcc 0
29 mol 156 unq 1 iso 1 dist 8.63783 7.69314 7.94975 9.50607 8.49473 13.8529 numMergedOcc 0
30 mol 156 unq 2 iso 0 dist 8.63783 9.50607 8.49473 16.0317 9.39865 15.5923 numMergedOcc 0
31 mol 156 unq 2 iso 1 dist 8.63783 16.0317 9.39865 9.50607 8.49473 15.5923 numMergedOcc 0
32 mol 156 unq 2 iso 0 dist 8.63783 7.69314 7.94975 16.0317 9.39865 10.8989 numMergedOcc 0
33 mol 156 unq 2 iso 1 dist 8.63783 16.0317 9.39865 7.69314 7.94975 10.8989 numMergedOcc 0
34 mol 156 unq 3 iso 0 dist 7.96867 7.00982 9.54367 7.69314 7.26859 8.88109 numMergedOcc 0
35 mol 156 unq 3 iso 1 dist 7.96867 7.69314 7.26859 7.00982 9.54367 8.88109 numMergedOcc 0
36 mol 163 unq 0 iso 0 dist 7.64106 10.9684 8.21476 8.9019 7.66897 7.11179 numMergedOcc 0
37 mol 163 unq 0 iso 1 dist 7.64106 8.9019 7.66897 10.9684 8.21476 7.11179 numMergedOcc 0
38 mol 189 unq 0 iso 0 dist 5.15305 5.79318 9.6013 4.88868 8.32712 4.7815 numMergedOcc 0
39 mol 189 unq 0 iso 1 dist 5.15305 4.88868 8.32712 5.79318 9.6013 4.7815 numMergedOcc 0
40 mol 238 unq 0 iso 0 dist 6.52129 12.4402 7.61203 12.4266 9.47845 5.39292 numMergedOcc 0
41 mol 238 unq 0 iso 1 dist 6.52129 12.4266 9.47845 12.4402 7.61203 5.39292 numMergedOcc 0
42 mol 238 unq 1 iso 0 dist 6.52129 12.4402 7.61203 11.091 6.92409 6.32518 numMergedOcc 0
43 mol 238 unq 1 iso 1 dist 6.52129 11.091 6.92409 12.4402 7.61203 6.32518 numMergedOcc 0
44 mol 238 unq 2 iso 0 dist 6.52129 12.4402 7.61203 10.4365 6.89694 9.50847 numMergedOcc 0
45 mol 238 unq 2 iso 1 dist 6.52129 10.4365 6.89694 12.4402 7.61203 9.50847 numMergedOcc 0
46 mol 238 unq 1 iso 0 dist 6.52129 12.4266 9.47845 11.091 6.92409 4.83721 numMergedOcc 0
47 mol 238 unq 1 iso 1 dist 6.52129 11.091 6.92409 12.4266 9.47845 4.83721 numMergedOcc 0
48 mol 238 unq 2 iso 0 dist 6.52129 12.4266 9.47845 10.4365 6.89694 13.7203 numMergedOcc 0
49 mol 238 unq 2 iso 1 dist 6.52129 10.4365 6.89694 12.4266 9.47845 13.7203 numMergedOcc 0
50 mol 238 unq 2 iso 0 dist 6.52129 11.091 6.92409 10.4365 6.89694 12.6266 numMergedOcc 0
51 mol 238 unq 2 iso 1 dist 6.52129 10.4365 6.89694 11.091 6.92409 12.6266 numMergedOcc 0
