0 mol 20 unq 0 iso 0 dist 9.12299 11.2048 9.55686 18.1188 14.7264 9.6259 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.42968 5.09348 7.18124 8.48944 3.67206 8.70016 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 5.42968 5.09348 7.18124 6.6834 11.1587 5.13078 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 5.42968 12.7612 8.10168 11.1757 5.75365 4.90881 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 5.42968 12.7612 8.10168 8.48944 3.67206 6.15382 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 5.94343 5.09348 6.47026 8.48944 8.93303 8.70016 numMergedOcc 0
6 mol 24 unq 5 iso 0 dist 5.94343 5.09348 6.47026 6.6834 8.72577 5.13078 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 7.51631 3.89292 8.32093 6.09085 7.18877 6.33905 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 9.85325 6.34787 6.48394 9.73435 5.36604 7.52245 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 6.54247 6.64448 9.24005 10.3611 5.38692 9.44847 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 6.54247 8.37067 7.88846 10.3611 5.38692 6.05839 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 6.61697 9.94078 8.46167 14.6426 13.3691 6.41507 numMergedOcc 0
12 mol 113 unq 1 iso 0 dist 6.61697 9.94078 8.46167 12.4669 9.59189 6.03035 numMergedOcc 0
13 mol 116 unq 0 iso 0 dist 8.83566 11.0898 7.39112 8.71812 3.43966 9.02925 numMergedOcc 0
14 mol 170 unq 0 iso 0 dist 8.56983 7.19735 5.14196 11.7268 3.58196 6.2845 numMergedOcc 0
15 mol 182 unq 0 iso 0 dist 7.12941 5.54591 7.30461 8.5093 3.53123 8.00791 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 9.2814 8.35709 5.24631 11.1269 3.41783 5.39915 numMergedOcc 0
17 mol 254 unq 0 iso 0 dist 8.9475 8.25455 8.07881 15.8086 11.4758 9.43831 numMergedOcc 0
18 mol 254 unq 1 iso 0 dist 8.26189 8.25455 5.44351 15.8086 8.8967 9.43831 numMergedOcc 0
19 mol 254 unq 2 iso 0 dist 7.57834 10.4418 6.34051 15.7954 10.929 9.43831 numMergedOcc 0
20 mol 254 unq 3 iso 0 dist 5.75348 8.25455 6.34051 15.8086 10.929 9.43831 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 8.82533 7.79908 7.59138 10.6179 6.41309 5.96416 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 4.54064 7.54263 9.68243 8.19223 9.98348 9.95932 numMergedOcc 0
