0 mol 33 unq 0 iso 0 dist 8.41282 4.41045 10.5926 6.08005 9.63263 10.0772 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 8.98939 9.57292 10.3765 8.89982 7.27383 15.6401 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 8.64047 8.15861 14.1233 13.4816 8.00777 18.405 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 8.64047 8.15861 14.1233 12.1235 7.1589 15.4008 numMergedOcc 0
4 mol 85 unq 2 iso 0 dist 8.64047 9.27814 4.06365 13.4816 8.00777 9.01812 numMergedOcc 0
5 mol 85 unq 3 iso 0 dist 8.64047 9.27814 4.06365 12.1235 7.1589 9.90583 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 7.46327 5.96189 5.99863 12.3373 9.81831 14.4051 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 7.46327 5.96189 5.99863 11.6592 9.12858 14.2439 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 7.46327 5.96189 5.99863 6.09816 9.4523 11.2863 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 8.28541 8.51084 12.2445 4.41283 7.71107 9.06601 numMergedOcc 0
10 mol 111 unq 1 iso 0 dist 8.28541 5.53271 3.75797 4.41283 7.71107 5.98809 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 8.56251 6.3472 8.56547 4.51874 4.92088 4.72821 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.67802 7.00382 8.54557 18.5326 9.83476 15.2176 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 7.44979 8.09863 8.42449 10.4409 8.0144 12.6443 numMergedOcc 0
14 mol 204 unq 1 iso 0 dist 7.44979 8.09863 8.42449 11.4774 7.80841 15.848 numMergedOcc 0
15 mol 218 unq 0 iso 0 dist 7.84953 6.46335 11.2216 6.66456 6.29367 11.8692 numMergedOcc 0
16 mol 218 unq 1 iso 0 dist 7.84953 6.46335 11.2216 5.09263 5.76954 7.84952 numMergedOcc 0
17 mol 218 unq 2 iso 0 dist 7.84953 6.46335 11.2216 10.1782 9.20961 12.5146 numMergedOcc 0
18 mol 218 unq 3 iso 0 dist 4.57726 6.46335 5.46009 6.66456 8.86175 11.8692 numMergedOcc 0
19 mol 218 unq 4 iso 0 dist 4.57726 6.46335 5.46009 5.09263 6.29511 7.84952 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 8.24118 9.31268 14.2452 10.2134 6.66971 11.8376 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 8.24118 9.31268 14.2452 12.8163 6.4398 14.8763 numMergedOcc 0
22 mol 238 unq 2 iso 0 dist 8.24118 9.31268 14.2452 5.88384 7.32982 9.76893 numMergedOcc 0
23 mol 252 unq 0 iso 0 dist 7.82138 8.88629 10.4138 7.66494 6.11473 11.065 numMergedOcc 0
24 mol 252 unq 1 iso 0 dist 9.27529 8.88629 6.33781 7.66494 6.53679 11.065 numMergedOcc 0
25 mol 252 unq 2 iso 0 dist 9.27529 8.88629 6.33781 12.8993 7.50201 12.8652 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 6.69569 8.15636 10.0855 15.9188 9.74402 18.0211 numMergedOcc 0
27 mol 287 unq 1 iso 0 dist 6.69569 7.86292 8.41058 15.9188 9.74402 17.3319 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 6.69569 8.15636 10.0855 15.9188 9.74402 18.0211 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 6.69569 7.86292 8.41058 15.9188 9.74402 17.3319 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 6.69569 8.15636 10.0855 15.9188 9.74402 18.0211 numMergedOcc 0
31 mol 289 unq 1 iso 0 dist 6.69569 7.86292 8.41058 15.9188 9.74402 17.3319 numMergedOcc 0
32 mol 294 unq 0 iso 0 dist 4.37724 7.58948 4.65086 9.41638 7.91611 8.88595 numMergedOcc 0
