0 mol 30 unq 0 iso 0 dist 7.92586 10.9576 6.93011 13.4319 5.92977 8.25499 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.72346 4.63315 6.57978 8.34858 6.1032 7.62469 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 7.45173 6.38992 6.57978 11.9284 6.1032 7.62469 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 8.32519 12.1015 8.96898 15.0313 7.10506 9.60892 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 4.7751 9.6653 9.13689 11.1253 6.80219 8.8894 numMergedOcc 0
5 mol 142 unq 0 iso 0 dist 6.4119 10.1777 6.81144 11.5686 5.19808 7.21779 numMergedOcc 0
6 mol 142 unq 1 iso 0 dist 8.40522 4.99169 6.81144 5.49328 5.19808 7.21779 numMergedOcc 0
7 mol 174 unq 0 iso 0 dist 6.85127 5.17022 8.63713 9.68082 6.77289 8.15275 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 8.15587 11.7954 8.98633 13.3583 5.41527 9.23669 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 9.2814 10.3578 9.95859 12.8445 8.39697 6.02053 numMergedOcc 0
10 mol 205 unq 1 iso 0 dist 9.2814 10.3578 9.95859 15.6798 12.776 7.41663 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 8.63808 7.73497 4.37138 15.0014 7.14354 9.82057 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 5.33881 6.75058 4.76164 12.5335 8.05498 8.13605 numMergedOcc 0
13 mol 261 unq 0 iso 0 dist 8.55479 6.94755 7.14871 12.1672 3.67073 9.38192 numMergedOcc 0
14 mol 261 unq 1 iso 0 dist 8.55479 6.94755 7.14871 10.965 9.24385 6.99444 numMergedOcc 0
