0 mol 7 unq 0 iso 0 dist 9.17764 4.68431 7.11539 5.1316 6.14469 6.44558 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 7.57901 7.2786 9.88507 5.02729 5.59965 11.04 numMergedOcc 0
2 mol 12 unq 0 iso 0 dist 6.05244 13.7296 9.52857 5.92892 5.76024 10.1802 numMergedOcc 0
3 mol 12 unq 1 iso 0 dist 6.05244 13.7296 9.52857 4.80294 7.92714 11.8349 numMergedOcc 0
4 mol 12 unq 2 iso 0 dist 6.05244 13.7296 9.52857 10.6891 8.47217 13.1322 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 4.9737 5.95398 5.56687 6.09666 6.93197 6.76331 numMergedOcc 0
6 mol 46 unq 0 iso 0 dist 8.12513 4.9813 8.23202 5.62202 8.0543 5.74722 numMergedOcc 0
7 mol 46 unq 1 iso 0 dist 6.9762 12.8946 8.23202 10.5748 8.0543 5.74722 numMergedOcc 0
8 mol 48 unq 0 iso 0 dist 8.69823 8.05728 7.1796 12.6813 8.19993 11.0606 numMergedOcc 0
9 mol 48 unq 1 iso 0 dist 8.69823 8.76375 9.16212 12.6813 8.19993 15.6648 numMergedOcc 0
10 mol 60 unq 0 iso 0 dist 8.6492 6.20761 6.65867 6.90833 8.97364 9.66932 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 9.84391 12.8105 9.58855 8.30856 8.42878 9.72019 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 9.63085 9.5684 9.75061 7.37795 5.87084 8.25083 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.76308 15.047 6.58212 9.75326 6.21159 10.8189 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 8.25221 5.09521 8.14859 11.3395 8.26288 14.4054 numMergedOcc 0
15 mol 192 unq 1 iso 0 dist 8.25221 5.09521 8.14859 8.47522 6.60053 9.72372 numMergedOcc 0
16 mol 192 unq 2 iso 0 dist 6.64416 5.09521 5.62421 8.47522 9.36796 9.72372 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 7.71605 8.39762 6.45143 5.424 5.70795 4.66376 numMergedOcc 0
18 mol 265 unq 0 iso 0 dist 7.87337 6.24185 9.68583 4.80754 8.984 4.15342 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 8.38581 17.5836 9.34312 7.10619 7.00243 14.8724 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 8.38581 8.37091 7.53905 7.10619 7.00243 5.01805 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 6.71956 10.2688 9.35976 7.01915 8.20644 10.7039 numMergedOcc 0
