0 mol 34 unq 0 iso 0 dist 6.88388 5.85441 8.63361 5.62969 6.15801 5.89577 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 6.88388 5.85441 8.63361 10.7064 9.63403 6.62645 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 6.88388 5.85441 8.63361 7.93313 8.07314 6.27366 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 4.35437 4.04916 7.51138 7.6026 7.31784 8.39589 numMergedOcc 0
4 mol 90 unq 1 iso 0 dist 4.35437 9.70636 9.86843 7.6026 7.31784 6.30226 numMergedOcc 0
5 mol 90 unq 2 iso 0 dist 4.35437 8.46448 6.86146 7.6026 7.31784 7.57639 numMergedOcc 0
6 mol 90 unq 3 iso 0 dist 4.35437 10.7717 8.83296 7.6026 7.31784 4.215 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 6.98059 6.96505 7.63183 6.41735 6.62972 9.50457 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 5.63127 11.4703 7.63183 11.1359 6.62972 9.50457 numMergedOcc 0
9 mol 105 unq 0 iso 0 dist 9.32471 11.3702 8.44437 4.32631 7.71923 7.41096 numMergedOcc 0
10 mol 105 unq 1 iso 0 dist 9.32471 11.3702 8.44437 8.17658 9.87821 4.88348 numMergedOcc 0
11 mol 105 unq 2 iso 0 dist 9.32471 11.3702 8.44437 10.4517 7.09806 4.22355 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 6.89591 13.5223 9.71408 6.71173 6.51014 9.78297 numMergedOcc 0
13 mol 193 unq 0 iso 0 dist 9.07517 10.9189 5.44396 7.09749 7.8141 6.03632 numMergedOcc 0
14 mol 193 unq 1 iso 0 dist 9.07517 10.9189 5.44396 11.2251 8.43187 10.6169 numMergedOcc 0
15 mol 193 unq 2 iso 0 dist 9.07517 7.05903 6.22972 7.09749 7.8141 7.58433 numMergedOcc 0
16 mol 193 unq 3 iso 0 dist 9.07517 7.05903 6.22972 11.2251 8.43187 5.56664 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 8.26119 9.55026 5.52678 11.9617 5.68348 8.43261 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 8.26119 5.81844 9.81666 11.9617 5.68348 13.8424 numMergedOcc 0
19 mol 194 unq 2 iso 0 dist 9.10338 7.42146 5.52678 6.96419 5.68348 8.43261 numMergedOcc 0
20 mol 194 unq 3 iso 0 dist 9.10338 14.7061 9.81666 6.96419 5.68348 13.8424 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 7.81918 12.4669 6.53728 10.526 8.20162 6.59663 numMergedOcc 0
22 mol 225 unq 1 iso 0 dist 8.92533 14.9481 6.53728 13.0081 8.20162 6.59663 numMergedOcc 0
23 mol 225 unq 2 iso 0 dist 7.55355 11.802 6.53728 6.17371 9.23935 14.3973 numMergedOcc 0
24 mol 225 unq 3 iso 0 dist 7.55355 11.802 6.53728 5.43186 7.77552 13.923 numMergedOcc 0
25 mol 260 unq 0 iso 0 dist 8.09112 7.60209 8.3149 4.48112 7.99521 7.16782 numMergedOcc 0
26 mol 260 unq 1 iso 0 dist 5.6002 6.52502 8.3149 5.72956 7.99521 7.16782 numMergedOcc 0
27 mol 264 unq 0 iso 0 dist 9.84667 11.6262 5.74568 9.08298 7.21655 11.5512 numMergedOcc 0
