0 mol 10 unq 0 iso 0 dist 9.48775 5.88107 9.78153 13.6392 11.0871 8.93461 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 9.27422 8.44709 7.50258 17.161 9.88128 9.99467 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 9.6177 6.24063 8.16246 11.899 4.64745 9.70196 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 9.6177 11.6553 9.48823 11.899 4.64745 9.25341 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.5663 12.0987 5.66803 6.48746 7.89444 9.82294 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.23755 10.3397 7.58027 11.9692 12.456 9.27044 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.23755 8.31117 4.34694 11.9692 12.456 8.98208 numMergedOcc 0
7 mol 103 unq 0 iso 0 dist 5.8915 8.4824 6.56481 10.9539 5.86578 8.23356 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 6.79014 5.41029 6.54778 13.6406 11.5575 8.79677 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 8.20904 12.8509 8.64054 16.2599 12.0212 8.83811 numMergedOcc 0
10 mol 128 unq 1 iso 0 dist 9.82711 6.61379 8.64054 11.351 12.0212 8.83811 numMergedOcc 0
11 mol 128 unq 2 iso 0 dist 5.96435 6.53583 8.64054 13.7453 12.0212 8.83811 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 7.47105 11.193 9.2759 16.1333 14.0828 6.9268 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 7.47105 11.193 9.2759 16.9054 11.5586 8.19166 numMergedOcc 0
14 mol 139 unq 0 iso 0 dist 7.83417 7.11333 8.78382 9.58468 4.94393 9.71665 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 6.85063 5.38327 5.32865 10.6859 7.75436 5.47265 numMergedOcc 0
16 mol 187 unq 0 iso 0 dist 9.55621 12.9459 8.0501 17.3255 8.91643 7.87608 numMergedOcc 0
17 mol 189 unq 0 iso 0 dist 8.01521 9.29575 6.38294 11.3573 4.79488 9.01418 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 8.82945 7.41218 7.36571 6.88947 4.65303 5.21088 numMergedOcc 0
19 mol 192 unq 1 iso 0 dist 8.82945 14.6803 9.17137 6.88947 4.65303 8.25609 numMergedOcc 0
20 mol 195 unq 0 iso 0 dist 8.3941 8.14211 5.61326 12.0497 4.03375 9.04342 numMergedOcc 0
21 mol 226 unq 0 iso 0 dist 6.3687 4.52889 8.74399 9.31677 9.96567 9.03261 numMergedOcc 0
22 mol 245 unq 0 iso 0 dist 8.03294 15.5115 7.95061 11.0831 5.43086 9.59668 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 7.72433 5.86368 6.57444 10.413 6.1113 7.3055 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 9.44017 10.4689 8.04712 15.8973 9.74634 8.99435 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 4.49395 6.49869 6.32984 5.77107 6.37482 7.38536 numMergedOcc 0
26 mol 293 unq 0 iso 0 dist 9.92737 7.23495 9.65156 11.4127 6.89397 8.04021 numMergedOcc 0
