0 mol 24 unq 0 iso 0 dist 8.3964 14.959 8.4051 10.0962 7.85986 6.7846 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.3964 14.959 8.4051 8.56474 4.30252 8.03955 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.3964 7.79468 7.29868 10.0962 7.85986 13.7992 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 8.3964 7.79468 7.29868 8.56474 4.30252 8.92779 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 8.3964 9.85198 8.60554 10.0962 7.85986 13.2846 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 8.3964 9.85198 8.60554 8.56474 4.30252 12.3897 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.18097 10.5346 9.82915 6.90443 8.04853 11.9949 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 9.18097 10.5346 9.82915 13.1381 6.46549 13.3089 numMergedOcc 0
8 mol 85 unq 2 iso 0 dist 8.83135 18.2314 9.82915 14.6513 8.04853 11.9949 numMergedOcc 0
9 mol 85 unq 3 iso 0 dist 8.83135 18.2314 9.82915 9.99421 6.46549 13.3089 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 6.93893 14.4094 9.30539 12.7678 9.97813 4.73184 numMergedOcc 0
11 mol 101 unq 0 iso 0 dist 7.73086 4.51951 6.98314 4.4529 9.44645 6.2696 numMergedOcc 0
12 mol 101 unq 1 iso 0 dist 7.73086 5.82598 7.61685 4.4529 9.44645 10.1773 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 6.86997 9.70656 9.91993 7.34563 9.17462 4.73245 numMergedOcc 0
14 mol 148 unq 1 iso 0 dist 6.86997 9.70656 9.91993 3.54257 8.74878 11.5545 numMergedOcc 0
15 mol 148 unq 2 iso 0 dist 6.86997 5.77745 9.99156 7.34563 9.17462 5.38701 numMergedOcc 0
16 mol 148 unq 3 iso 0 dist 6.86997 5.77745 9.99156 3.54257 8.74878 6.77599 numMergedOcc 0
17 mol 148 unq 4 iso 0 dist 7.46919 9.70656 6.22055 7.34563 5.75959 4.73245 numMergedOcc 0
18 mol 148 unq 5 iso 0 dist 7.46919 5.77745 8.18085 7.34563 5.75959 5.38701 numMergedOcc 0
19 mol 150 unq 0 iso 0 dist 6.79381 9.69704 9.96691 7.33121 9.01668 4.73768 numMergedOcc 0
20 mol 150 unq 1 iso 0 dist 6.79381 9.69704 9.96691 3.59609 8.74018 11.5728 numMergedOcc 0
21 mol 150 unq 2 iso 0 dist 6.79381 5.71213 9.8656 7.33121 9.01668 5.46333 numMergedOcc 0
22 mol 150 unq 3 iso 0 dist 6.79381 5.71213 9.8656 3.59609 8.74018 6.74495 numMergedOcc 0
23 mol 150 unq 4 iso 0 dist 7.36989 9.69704 6.14675 7.33121 5.4798 4.73768 numMergedOcc 0
24 mol 150 unq 5 iso 0 dist 7.36989 5.71213 7.94889 7.33121 5.4798 5.46333 numMergedOcc 0
25 mol 150 unq 6 iso 0 dist 8.17805 9.69704 9.24244 7.33121 6.32391 4.73768 numMergedOcc 0
26 mol 151 unq 0 iso 0 dist 9.15141 9.74883 5.93692 13.6484 8.1948 6.93455 numMergedOcc 0
27 mol 158 unq 0 iso 0 dist 8.07946 5.23723 8.647 5.34159 7.20362 6.05019 numMergedOcc 0
28 mol 188 unq 0 iso 0 dist 6.20426 9.41911 8.10214 8.6599 8.4784 8.02684 numMergedOcc 0
29 mol 194 unq 0 iso 0 dist 5.4455 13.445 8.65535 11.7008 8.43182 12.8006 numMergedOcc 0
30 mol 198 unq 0 iso 0 dist 8.28295 4.81051 6.34616 7.8747 8.78623 4.27652 numMergedOcc 0
31 mol 205 unq 0 iso 0 dist 5.63477 4.25942 6.03688 3.50159 5.59832 6.49049 numMergedOcc 0
32 mol 232 unq 0 iso 0 dist 8.27761 10.1991 8.50102 11.775 9.78273 6.95968 numMergedOcc 0
33 mol 232 unq 1 iso 0 dist 8.27761 13.7819 9.40808 11.775 9.78273 4.04428 numMergedOcc 0
34 mol 241 unq 0 iso 0 dist 9.30143 8.4988 7.89524 5.1104 8.73192 4.07839 numMergedOcc 0
35 mol 244 unq 0 iso 0 dist 9.97458 10.5547 5.50492 4.80974 9.30179 8.49798 numMergedOcc 0
36 mol 244 unq 1 iso 0 dist 9.97458 10.5547 5.50492 13.59 6.10489 9.54706 numMergedOcc 0
37 mol 244 unq 2 iso 0 dist 9.97458 10.5547 5.50492 12.146 4.4204 4.06591 numMergedOcc 0
38 mol 278 unq 0 iso 0 dist 9.73172 4.7203 8.00673 14.4747 8.1769 13.7796 numMergedOcc 0
39 mol 278 unq 1 iso 0 dist 9.73172 4.7203 8.00673 10.0491 7.1656 10.2359 numMergedOcc 0
40 mol 278 unq 2 iso 0 dist 9.73172 6.42903 6.62841 14.4747 8.1769 9.26354 numMergedOcc 0
41 mol 278 unq 3 iso 0 dist 9.73172 6.42903 6.62841 10.0491 7.1656 5.33325 numMergedOcc 0
42 mol 292 unq 0 iso 0 dist 8.67838 11.3822 9.88863 9.75548 9.373 9.81399 numMergedOcc 0
