0 mol 18 unq 0 iso 0 dist 9.2978 7.37356 10.1903 5.53781 8.69189 12.0245 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 9.2978 7.37356 10.1903 4.84965 6.41856 8.51213 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 7.37356 9.2978 10.1903 4.84965 8.51213 6.41856 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 6.84521 8.90024 5.06502 5.00932 8.99509 8.47617 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 6.84521 6.78532 5.89973 5.00932 8.99509 5.73331 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 8.90024 6.84521 5.06502 5.00932 8.47617 8.99509 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 8.90024 6.78532 6.45462 5.00932 8.47617 5.73331 numMergedOcc 0
7 mol 43 unq 4 iso 0 dist 6.78532 6.84521 5.89973 5.00932 5.73331 8.99509 numMergedOcc 0
8 mol 43 unq 5 iso 0 dist 6.78532 8.90024 6.45462 5.00932 5.73331 8.47617 numMergedOcc 0
9 mol 89 unq 0 iso 0 dist 8.85873 7.3606 6.88931 5.19804 5.25504 7.84991 numMergedOcc 0
10 mol 89 unq 1 iso 0 dist 7.3606 8.85873 6.88931 5.19804 7.84991 5.25504 numMergedOcc 0
11 mol 110 unq 0 iso 0 dist 9.9633 8.64633 5.00116 12.0707 8.93253 13.1286 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 7.30919 8.31276 14.069 14.4662 8.75736 17.9377 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 7.30919 8.31276 14.069 12.021 6.76166 15.8865 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 7.30919 5.79157 8.25185 14.4662 8.75736 14.6355 numMergedOcc 0
15 mol 134 unq 3 iso 0 dist 7.30919 5.79157 8.25185 12.021 6.76166 14.067 numMergedOcc 0
16 mol 134 unq 4 iso 0 dist 7.30919 5.50687 6.90348 14.4662 8.75736 15.6314 numMergedOcc 0
17 mol 134 unq 5 iso 0 dist 7.30919 5.50687 6.90348 12.021 6.76166 13.0826 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 6.0639 6.91355 6.85436 5.18812 9.71735 9.04898 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 6.91355 6.0639 6.85436 5.18812 9.04898 9.71735 numMergedOcc 0
20 mol 196 unq 0 iso 0 dist 9.36732 9.79271 12.9389 14.2286 7.23126 14.3686 numMergedOcc 0
21 mol 196 unq 1 iso 0 dist 9.36732 9.79271 12.9389 16.543 7.82805 20.1592 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 9.39537 8.97461 14.0328 5.81253 8.39522 5.99187 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 9.39537 8.89487 15.8898 5.81253 8.39522 9.93378 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 8.97461 9.39537 14.0328 5.81253 5.99187 8.39522 numMergedOcc 0
25 mol 238 unq 3 iso 0 dist 8.97461 8.89487 6.85126 5.81253 5.99187 9.93378 numMergedOcc 0
26 mol 238 unq 4 iso 0 dist 8.89487 9.39537 15.8898 5.81253 9.93378 8.39522 numMergedOcc 0
27 mol 238 unq 5 iso 0 dist 8.89487 8.97461 6.85126 5.81253 9.93378 5.99187 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 9.2067 9.16078 5.30627 10.9933 5.31858 5.71851 numMergedOcc 0
29 mol 258 unq 1 iso 0 dist 9.16078 9.2067 5.30627 10.9933 5.71851 5.31858 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 7.151 8.53324 7.69449 8.68474 6.70123 13.8031 numMergedOcc 0
31 mol 277 unq 1 iso 0 dist 7.151 7.23956 11.8268 8.68474 6.70123 15.6541 numMergedOcc 0
32 mol 277 unq 2 iso 0 dist 7.23956 7.151 11.8268 5.13652 9.64889 11.1337 numMergedOcc 0
33 mol 277 unq 3 iso 0 dist 7.23956 8.53324 7.08227 5.13652 9.64889 12.6823 numMergedOcc 0
34 mol 277 unq 4 iso 0 dist 8.33977 8.66941 7.69449 13.3428 6.70123 13.8031 numMergedOcc 0
35 mol 284 unq 0 iso 0 dist 7.43241 9.98268 17.2899 15.2838 9.12551 25.0782 numMergedOcc 0
36 mol 284 unq 1 iso 0 dist 7.43241 6.83147 13.5089 15.2838 9.12551 21.6808 numMergedOcc 0
