0 mol 2 unq 0 iso 0 dist 9.74371 11.5183 6.3286 5.30739 9.57674 8.16405 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 8.23606 9.45345 8.96839 9.24792 7.42925 5.50617 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 7.11187 4.18245 6.03038 12.8792 9.95103 13.2428 numMergedOcc 0
3 mol 100 unq 1 iso 0 dist 7.11187 9.53861 9.21675 12.8792 9.95103 4.50298 numMergedOcc 0
4 mol 100 unq 2 iso 0 dist 6.60356 11.3097 6.03038 10.0156 9.95103 13.2428 numMergedOcc 0
5 mol 100 unq 3 iso 0 dist 6.60356 10.0584 9.21675 10.0156 9.95103 4.50298 numMergedOcc 0
6 mol 135 unq 0 iso 0 dist 6.76073 5.0669 9.2927 9.49501 9.03598 13.1573 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 6.4737 13.0157 9.61301 11.2656 9.06844 5.75305 numMergedOcc 0
8 mol 175 unq 0 iso 0 dist 6.21546 7.8384 8.9395 10.3139 9.27911 9.31217 numMergedOcc 0
9 mol 175 unq 1 iso 0 dist 6.21546 7.8384 8.9395 7.04147 8.57607 6.5271 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 8.94671 5.38392 9.72584 12.3479 9.68323 9.10278 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 9.68829 13.2974 9.83104 10.2119 9.28818 4.04737 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 7.75205 10.081 9.83104 10.1438 9.28818 4.04737 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 8.63033 9.30262 7.44186 4.77368 6.69623 6.97126 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 6.24111 10.6912 8.78286 6.15611 8.87054 8.06815 numMergedOcc 0
15 mol 210 unq 1 iso 0 dist 9.00343 15.1716 8.78286 10.7435 8.87054 8.06815 numMergedOcc 0
16 mol 210 unq 2 iso 0 dist 6.41444 11.533 8.78286 7.26107 8.87054 8.06815 numMergedOcc 0
17 mol 219 unq 0 iso 0 dist 4.67452 5.39853 6.65093 6.66401 9.30312 10.8057 numMergedOcc 0
18 mol 219 unq 1 iso 0 dist 9.86916 11.6173 6.65093 13.9364 9.30312 10.8057 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 8.32298 9.58476 9.16869 5.72903 7.64854 4.09076 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 6.00654 12.6605 9.42537 5.86546 5.4347 8.05078 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 8.73077 13.1019 7.94491 11.4974 9.69025 10.7343 numMergedOcc 0
22 mol 259 unq 1 iso 0 dist 6.76656 12.1307 7.94491 7.39099 9.69025 10.7343 numMergedOcc 0
23 mol 260 unq 0 iso 0 dist 8.13696 10.1869 7.76322 6.83989 9.56846 10.9471 numMergedOcc 0
24 mol 285 unq 0 iso 0 dist 4.74716 6.63786 8.45077 6.15563 8.7964 12.5053 numMergedOcc 0
25 mol 285 unq 1 iso 0 dist 4.74716 6.63786 8.45077 5.52409 7.24072 9.87956 numMergedOcc 0
