0 mol 7 unq 0 iso 0 dist 8.23909 13.823 9.60499 13.4186 11.5784 9.85726 numMergedOcc 0
1 mol 7 unq 0 iso 1 dist 9.85726 11.5784 9.60499 13.4186 13.823 8.23909 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 9.85726 11.5784 9.60499 12.8174 5.38502 6.72215 numMergedOcc 0
3 mol 7 unq 1 iso 1 dist 6.72215 5.38502 9.60499 12.8174 11.5784 9.85726 numMergedOcc 0
4 mol 14 unq 0 iso 0 dist 8.73627 9.18933 6.38364 7.54797 7.00835 8.39221 numMergedOcc 0
5 mol 14 unq 0 iso 1 dist 8.39221 7.00835 6.38364 7.54797 9.18933 8.73627 numMergedOcc 0
6 mol 16 unq 0 iso 0 dist 8.33883 5.45161 6.31718 9.57392 5.35079 5.84479 numMergedOcc 0
7 mol 16 unq 0 iso 1 dist 5.84479 5.35079 6.31718 9.57392 5.45161 8.33883 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.514 11.8037 7.4729 15.7233 10.7572 4.98104 numMergedOcc 0
9 mol 92 unq 0 iso 1 dist 4.98104 10.7572 7.4729 15.7233 11.8037 9.514 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 9.10229 8.17186 7.36792 14.2643 6.42572 9.01767 numMergedOcc 0
11 mol 102 unq 0 iso 1 dist 9.01767 6.42572 7.36792 14.2643 8.17186 9.10229 numMergedOcc 0
12 mol 102 unq 1 iso 0 dist 9.10229 8.17186 7.36792 10.1221 5.54551 9.80678 numMergedOcc 0
13 mol 102 unq 1 iso 1 dist 9.80678 5.54551 7.36792 10.1221 8.17186 9.10229 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 7.70533 14.3476 7.90328 12.9519 10.4589 9.85576 numMergedOcc 0
15 mol 117 unq 0 iso 1 dist 9.85576 10.4589 7.90328 12.9519 14.3476 7.70533 numMergedOcc 0
16 mol 126 unq 0 iso 0 dist 9.54928 7.01529 6.06638 14.0431 9.07346 9.06961 numMergedOcc 0
17 mol 126 unq 0 iso 1 dist 9.06961 9.07346 6.06638 14.0431 7.01529 9.54928 numMergedOcc 0
18 mol 152 unq 0 iso 0 dist 8.89982 13.2491 8.56324 11.1224 9.66339 9.10619 numMergedOcc 0
19 mol 152 unq 0 iso 1 dist 9.10619 9.66339 8.56324 11.1224 13.2491 8.89982 numMergedOcc 0
20 mol 156 unq 0 iso 0 dist 7.30021 12.865 9.83699 15.865 9.27577 9.16591 numMergedOcc 0
21 mol 156 unq 0 iso 1 dist 9.16591 9.27577 9.83699 15.865 12.865 7.30021 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 9.8711 4.90657 9.23153 9.58724 14.6296 7.31105 numMergedOcc 0
23 mol 220 unq 0 iso 1 dist 7.31105 14.6296 9.23153 9.58724 4.90657 9.8711 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 6.56437 14.2632 8.95269 5.90784 5.41021 9.33771 numMergedOcc 0
25 mol 224 unq 0 iso 1 dist 9.33771 5.41021 8.95269 5.90784 14.2632 6.56437 numMergedOcc 0
26 mol 224 unq 1 iso 0 dist 6.23882 15.0038 8.95269 9.97504 5.41021 9.33771 numMergedOcc 0
27 mol 224 unq 1 iso 1 dist 9.33771 5.41021 8.95269 9.97504 15.0038 6.23882 numMergedOcc 0
28 mol 224 unq 2 iso 0 dist 9.53131 9.59595 8.95269 8.50322 5.41021 9.33771 numMergedOcc 0
29 mol 224 unq 2 iso 1 dist 9.33771 5.41021 8.95269 8.50322 9.59595 9.53131 numMergedOcc 0
30 mol 224 unq 3 iso 0 dist 9.34636 5.63485 8.95269 11.1636 5.41021 9.33771 numMergedOcc 0
31 mol 224 unq 3 iso 1 dist 9.33771 5.41021 8.95269 11.1636 5.63485 9.34636 numMergedOcc 0
32 mol 224 unq 4 iso 0 dist 9.33771 4.91322 6.57273 11.1636 5.63485 9.79616 numMergedOcc 0
33 mol 224 unq 4 iso 1 dist 9.79616 5.63485 6.57273 11.1636 4.91322 9.33771 numMergedOcc 0
34 mol 224 unq 5 iso 0 dist 9.33771 12.979 5.78342 12.5889 4.8786 9.29703 numMergedOcc 0
35 mol 224 unq 5 iso 1 dist 9.29703 4.8786 5.78342 12.5889 12.979 9.33771 numMergedOcc 0
36 mol 224 unq 6 iso 0 dist 7.39839 4.91322 6.60589 11.1636 9.36962 9.79616 numMergedOcc 0
37 mol 224 unq 6 iso 1 dist 9.79616 9.36962 6.60589 11.1636 4.91322 7.39839 numMergedOcc 0
38 mol 224 unq 7 iso 0 dist 7.39839 12.979 9.16166 12.5889 7.18448 9.29703 numMergedOcc 0
39 mol 224 unq 7 iso 1 dist 9.29703 7.18448 9.16166 12.5889 12.979 7.39839 numMergedOcc 0
40 mol 230 unq 0 iso 0 dist 8.43766 7.07028 6.7547 10.1534 6.9602 8.49299 numMergedOcc 0
41 mol 230 unq 0 iso 1 dist 8.49299 6.9602 6.7547 10.1534 7.07028 8.43766 numMergedOcc 0
42 mol 236 unq 0 iso 0 dist 8.77254 5.74377 8.04248 10.4188 6.0258 9.10613 numMergedOcc 0
43 mol 236 unq 0 iso 1 dist 9.10613 6.0258 8.04248 10.4188 5.74377 8.77254 numMergedOcc 0
44 mol 238 unq 0 iso 0 dist 9.75174 13.477 6.57393 18.6237 10.8336 6.83152 numMergedOcc 0
45 mol 238 unq 0 iso 1 dist 6.83152 10.8336 6.57393 18.6237 13.477 9.75174 numMergedOcc 0
46 mol 259 unq 0 iso 0 dist 9.58006 11.8501 7.46176 18.6151 14.8465 7.93997 numMergedOcc 0
47 mol 259 unq 0 iso 1 dist 7.93997 14.8465 7.46176 18.6151 11.8501 9.58006 numMergedOcc 0
