0 mol 43 unq 0 iso 0 dist 9.16827 12.092 6.20293 19.6692 13.1056 8.03754 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.16827 10.7423 8.93915 13.5699 9.92508 9.47348 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 7.67586 11.7065 7.71095 19.9041 13.0222 9.83775 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 8.97292 14.1347 7.71095 18.8841 13.0222 9.83775 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 9.99643 8.2572 6.72123 7.45482 4.78811 8.44473 numMergedOcc 0
5 mol 70 unq 0 iso 0 dist 9.74268 6.95018 9.65964 13.0996 5.43139 9.74802 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 8.22406 5.41023 9.64443 7.75977 9.54167 7.11695 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 6.05043 6.40193 7.27724 12.6033 12.0894 9.64673 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 5.09688 12.2879 7.47343 17.7333 12.9061 9.22737 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 9.26343 16.4386 7.47343 21.0462 12.9061 9.22737 numMergedOcc 0
10 mol 167 unq 0 iso 0 dist 6.64164 5.361 9.87651 5.32056 6.45463 9.23645 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 6.01118 9.73148 6.69288 17.498 14.4816 9.63185 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 7.36642 9.43922 7.26832 12.0797 5.04299 7.51951 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 7.19917 9.55205 6.18308 10.5794 5.4508 6.13878 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.93637 14.8074 9.23153 16.1793 13.3213 5.39218 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 7.13194 9.05069 5.72887 12.7015 7.04671 4.80834 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 7.80166 6.77788 5.72887 8.66923 7.04671 4.80834 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 7.22378 6.8193 6.60405 14.3889 8.81588 9.04358 numMergedOcc 0
18 mol 261 unq 0 iso 0 dist 7.26647 4.95196 7.73141 9.83819 5.09097 9.77784 numMergedOcc 0
19 mol 261 unq 1 iso 0 dist 7.26647 9.29412 8.43057 9.83819 5.09097 5.00128 numMergedOcc 0
20 mol 261 unq 2 iso 0 dist 7.26647 9.29412 8.43057 15.4115 11.9784 6.58604 numMergedOcc 0
21 mol 261 unq 3 iso 0 dist 7.26647 9.29412 8.43057 14.5563 11.6843 7.30472 numMergedOcc 0
22 mol 261 unq 4 iso 0 dist 7.7309 9.29412 6.05727 9.83819 4.86901 5.00128 numMergedOcc 0
23 mol 261 unq 5 iso 0 dist 7.7309 9.29412 6.05727 15.4115 9.47323 6.58604 numMergedOcc 0
24 mol 261 unq 6 iso 0 dist 7.7309 9.29412 6.05727 14.5563 7.78464 7.30472 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 7.70229 8.93697 8.76532 14.4176 11.2986 7.71088 numMergedOcc 0
26 mol 282 unq 1 iso 0 dist 7.90792 8.93697 6.33524 14.4176 7.46064 7.71088 numMergedOcc 0
