0 mol 1 unq 0 iso 0 dist 6.06669 5.1888 5.74199 7.59404 5.55519 8.61411 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.40835 13.4556 9.25986 17.4673 9.45747 8.98177 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.72716 6.27103 8.30431 13.7417 8.24748 9.67403 numMergedOcc 0
3 mol 61 unq 1 iso 0 dist 9.72716 6.27103 8.30431 10.7951 14.4616 7.28917 numMergedOcc 0
4 mol 61 unq 2 iso 0 dist 9.72716 6.86236 4.628 16.6237 9.53688 9.82315 numMergedOcc 0
5 mol 86 unq 0 iso 0 dist 9.94012 15.1412 8.39046 15.9657 8.44581 8.43093 numMergedOcc 0
6 mol 86 unq 1 iso 0 dist 5.85076 8.96878 8.39046 10.6668 8.44581 8.43093 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 9.52282 11.2351 6.60356 18.1242 13.5152 8.52125 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 5.86949 6.33907 9.71692 14.4197 14.778 9.22427 numMergedOcc 0
9 mol 148 unq 1 iso 0 dist 6.72591 7.50382 9.71692 8.6499 14.778 9.22427 numMergedOcc 0
10 mol 150 unq 0 iso 0 dist 5.84971 6.43607 9.73708 14.599 14.922 9.32504 numMergedOcc 0
11 mol 150 unq 1 iso 0 dist 6.80192 7.48524 9.73708 8.75339 14.922 9.32504 numMergedOcc 0
12 mol 192 unq 0 iso 0 dist 9.67207 8.0557 7.30965 12.4049 13.2525 7.252 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 4.90334 6.42715 7.00683 8.82838 5.55359 7.19213 numMergedOcc 0
14 mol 204 unq 1 iso 0 dist 4.90334 6.42715 7.00683 8.17025 4.72843 5.67196 numMergedOcc 0
15 mol 211 unq 0 iso 0 dist 5.02094 9.43858 9.8921 12.1348 12.6613 7.38723 numMergedOcc 0
16 mol 212 unq 0 iso 0 dist 8.02266 10.6347 9.26387 12.7408 7.5418 7.73701 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 7.6174 8.00807 7.20862 13.0541 6.92911 8.10096 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 9.09371 9.22288 5.2851 7.49227 7.27568 6.14732 numMergedOcc 0
19 mol 245 unq 0 iso 0 dist 7.1207 6.87827 6.41862 13.159 6.62389 8.91609 numMergedOcc 0
20 mol 245 unq 1 iso 0 dist 7.1207 6.87827 6.41862 10.5858 5.43086 6.58637 numMergedOcc 0
21 mol 245 unq 2 iso 0 dist 7.1207 9.93908 8.69377 10.5858 5.43086 5.48167 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 9.73735 5.48962 8.73077 9.61409 7.78289 5.98006 numMergedOcc 0
23 mol 259 unq 1 iso 0 dist 6.6238 5.48962 6.76656 9.61409 5.73217 5.98006 numMergedOcc 0
24 mol 259 unq 2 iso 0 dist 9.49732 17.4311 8.91916 13.7729 6.92619 7.97113 numMergedOcc 0
25 mol 259 unq 3 iso 0 dist 9.49732 17.4311 8.91916 19.0128 11.3266 8.38479 numMergedOcc 0
26 mol 259 unq 4 iso 0 dist 9.49732 12.8835 4.55368 13.7729 6.92619 5.22111 numMergedOcc 0
27 mol 259 unq 5 iso 0 dist 9.49732 12.8835 4.55368 19.0128 11.3266 8.53598 numMergedOcc 0
28 mol 279 unq 0 iso 0 dist 5.00402 10.1637 9.98985 12.8708 12.8228 4.75866 numMergedOcc 0
29 mol 279 unq 1 iso 0 dist 5.00402 10.1637 9.98985 12.1634 8.51381 7.87072 numMergedOcc 0
30 mol 283 unq 0 iso 0 dist 8.821 5.9309 7.53773 5.33054 5.37953 7.90132 numMergedOcc 0
