0 mol 0 unq 0 iso 0 dist 9.42137 7.65884 9.23213 11.2184 12.9149 8.66548 14.1874 15.944 8.8123 5.88757 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.7522 11.7823 6.73162 9.90986 7.11305 9.96121 6.77783 13.2086 14.531 9.06516 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.58841 13.8628 8.19682 22.3883 15.4159 9.4866 22.659 18.5663 10.6948 9.40363 numMergedOcc 0
3 mol 86 unq 0 iso 0 dist 8.88225 14.1743 7.79359 14.521 5.9022 5.88159 14.6191 10.5799 6.4158 9.29889 numMergedOcc 0
4 mol 86 unq 1 iso 0 dist 9.49308 12.091 7.79359 14.1958 5.9022 5.88159 15.0417 10.5799 6.4158 9.29889 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 8.3164 5.49138 5.87358 8.30089 6.35679 8.38791 5.64346 11.6478 8.08303 8.86037 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 7.91337 6.02826 7.39889 14.6053 14.443 9.08536 13.8574 15.1819 8.58342 6.13374 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 4.44292 4.40049 7.39644 7.25009 7.10286 5.36254 8.63858 11.5473 5.68272 7.29911 numMergedOcc 0
8 mol 218 unq 0 iso 0 dist 8.5119 11.711 7.17547 19.1373 15.6802 8.61306 9.87203 9.29802 4.63933 9.59426 numMergedOcc 0
9 mol 234 unq 0 iso 0 dist 7.86368 16.9465 9.5707 10.9409 3.95629 8.27411 15.442 7.85175 5.32617 7.36208 numMergedOcc 0
10 mol 234 unq 1 iso 0 dist 7.86368 16.9465 9.5707 23.0926 15.9732 6.96257 20.1468 12.5293 6.31377 6.86569 numMergedOcc 0
11 mol 234 unq 2 iso 0 dist 7.86368 15.442 7.85175 10.9409 3.95629 7.36208 16.9465 9.5707 5.32617 8.27411 numMergedOcc 0
12 mol 234 unq 3 iso 0 dist 7.46434 4.21173 6.16063 12.6209 13.1872 9.11572 16.6075 13.2498 12.4341 9.49229 numMergedOcc 0
13 mol 234 unq 4 iso 0 dist 7.46434 4.21173 6.16063 12.6209 13.1872 9.11572 14.9393 11.4691 10.9755 7.20293 numMergedOcc 0
14 mol 234 unq 5 iso 0 dist 7.50424 13.0543 6.16063 18.3012 13.1872 9.11572 14.2177 13.2498 12.4341 9.49229 numMergedOcc 0
15 mol 234 unq 6 iso 0 dist 7.50424 13.0543 6.16063 18.3012 13.1872 9.11572 13.7815 11.4691 10.9755 7.20293 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.13537 6.16476 5.38637 11.7874 13.378 9.38131 5.72503 9.98024 6.44245 6.85253 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 9.13537 6.16476 5.38637 11.7874 13.378 9.38131 17.9039 14.7057 13.7867 9.08687 numMergedOcc 0
18 mol 238 unq 2 iso 0 dist 9.66555 8.92175 7.49471 12.6412 12.7938 5.43613 14.2865 10.9946 6.34909 7.06768 numMergedOcc 0
19 mol 238 unq 3 iso 0 dist 9.66555 8.92175 7.49471 6.96382 6.82305 7.24334 13.1765 12.1937 9.50847 7.39547 numMergedOcc 0
20 mol 238 unq 4 iso 0 dist 8.67205 5.94371 7.49471 9.72795 12.7938 5.43613 9.72668 10.9946 6.34909 7.06768 numMergedOcc 0
21 mol 238 unq 5 iso 0 dist 8.67205 5.94371 7.49471 8.6732 6.82305 7.24334 13.7646 12.1937 9.50847 7.39547 numMergedOcc 0
