0 mol 24 unq 0 iso 0 dist 8.0319 4.19221 7.49157 6.17633 7.73794 4.10458 numMergedOcc 0
1 mol 24 unq 0 iso 1 dist 8.0319 6.17633 7.73794 4.19221 7.49157 4.10458 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.80897 4.28862 7.98005 4.93643 8.31381 6.92384 numMergedOcc 0
3 mol 26 unq 0 iso 1 dist 9.80897 4.93643 8.31381 4.28862 7.98005 6.92384 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 8.37225 5.34503 7.98005 4.74002 8.31381 6.92384 numMergedOcc 0
5 mol 26 unq 1 iso 1 dist 8.37225 4.74002 8.31381 5.34503 7.98005 6.92384 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 8.0139 4.15002 5.25027 9.36535 4.37025 5.30569 numMergedOcc 0
7 mol 79 unq 0 iso 1 dist 8.0139 9.36535 4.37025 4.15002 5.25027 5.30569 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 9.64641 4.41479 8.11702 10.3271 7.44558 9.99088 numMergedOcc 0
9 mol 109 unq 0 iso 1 dist 9.64641 10.3271 7.44558 4.41479 8.11702 9.99088 numMergedOcc 0
10 mol 117 unq 0 iso 0 dist 9.32858 5.24084 7.78789 9.30266 7.42146 9.77711 numMergedOcc 0
11 mol 117 unq 0 iso 1 dist 9.32858 9.30266 7.42146 5.24084 7.78789 9.77711 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 8.00624 6.61102 7.97548 9.0678 9.64164 5.83342 numMergedOcc 0
13 mol 129 unq 0 iso 1 dist 8.00624 9.0678 9.64164 6.61102 7.97548 5.83342 numMergedOcc 0
14 mol 147 unq 0 iso 0 dist 9.88662 10.0388 6.73617 9.71714 9.03544 3.6066 numMergedOcc 0
15 mol 147 unq 0 iso 1 dist 9.88662 9.71714 9.03544 10.0388 6.73617 3.6066 numMergedOcc 0
16 mol 163 unq 0 iso 0 dist 8.32426 6.32469 9.90947 5.57089 8.16252 3.25368 numMergedOcc 0
17 mol 163 unq 0 iso 1 dist 8.32426 5.57089 8.16252 6.32469 9.90947 3.25368 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 8.82388 10.8478 9.19385 7.50228 7.14243 11.5519 numMergedOcc 0
19 mol 253 unq 0 iso 1 dist 8.82388 7.50228 7.14243 10.8478 9.19385 11.5519 numMergedOcc 0
20 mol 253 unq 1 iso 0 dist 8.82388 10.8478 9.19385 10.7148 5.77511 13.6905 numMergedOcc 0
21 mol 253 unq 1 iso 1 dist 8.82388 10.7148 5.77511 10.8478 9.19385 13.6905 numMergedOcc 0
22 mol 253 unq 2 iso 0 dist 8.82388 10.8478 9.19385 10.7198 7.81382 15.953 numMergedOcc 0
23 mol 253 unq 2 iso 1 dist 8.82388 10.7198 7.81382 10.8478 9.19385 15.953 numMergedOcc 0
24 mol 253 unq 1 iso 0 dist 8.82388 7.50228 7.14243 10.7148 5.77511 5.35859 numMergedOcc 0
25 mol 253 unq 1 iso 1 dist 8.82388 10.7148 5.77511 7.50228 7.14243 5.35859 numMergedOcc 0
26 mol 253 unq 2 iso 0 dist 8.82388 7.50228 7.14243 10.7198 7.81382 6.37556 numMergedOcc 0
27 mol 253 unq 2 iso 1 dist 8.82388 10.7198 7.81382 7.50228 7.14243 6.37556 numMergedOcc 0
28 mol 253 unq 2 iso 0 dist 8.82388 10.7148 5.77511 10.7198 7.81382 3.10832 numMergedOcc 0
29 mol 253 unq 2 iso 1 dist 8.82388 10.7198 7.81382 10.7148 5.77511 3.10832 numMergedOcc 0
30 mol 258 unq 0 iso 0 dist 7.69358 6.09845 7.12221 11.3756 5.4557 8.40845 numMergedOcc 0
31 mol 258 unq 0 iso 1 dist 7.69358 11.3756 5.4557 6.09845 7.12221 8.40845 numMergedOcc 0
32 mol 274 unq 0 iso 0 dist 8.88221 4.66969 8.12739 5.69247 6.09853 5.57024 numMergedOcc 0
33 mol 274 unq 0 iso 1 dist 8.88221 5.69247 6.09853 4.66969 8.12739 5.57024 numMergedOcc 0
34 mol 274 unq 1 iso 0 dist 9.65027 12.3693 8.12739 6.93195 6.09853 5.57024 numMergedOcc 0
35 mol 274 unq 1 iso 1 dist 9.65027 6.93195 6.09853 12.3693 8.12739 5.57024 numMergedOcc 0
36 mol 277 unq 0 iso 0 dist 4.81916 9.21484 4.9764 10.3506 6.36559 3.41319 numMergedOcc 0
37 mol 277 unq 0 iso 1 dist 4.81916 10.3506 6.36559 9.21484 4.9764 3.41319 numMergedOcc 0
