0 mol 8 unq 0 iso 0 dist 9.95422 8.68949 7.19549 6.04779 8.9354 7.74386 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.65219 8.68949 4.77791 6.04779 8.13238 7.74386 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 7.99091 8.04019 10.4304 6.90464 12.1648 8.0346 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.79678 8.84944 4.22382 11.3412 11.6914 7.67459 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 5.24823 6.79959 6.4251 10.503 13.7597 8.88401 numMergedOcc 0
5 mol 104 unq 0 iso 0 dist 7.63919 5.71279 10.0228 5.78815 13.3745 7.32917 numMergedOcc 0
6 mol 104 unq 1 iso 0 dist 7.63919 5.71279 10.0228 10.2942 17.4271 8.84844 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 9.08036 9.19171 13.8836 9.57821 17.2523 6.45169 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.4963 8.8353 5.25819 7.82218 8.79837 5.92836 numMergedOcc 0
9 mol 165 unq 0 iso 0 dist 7.74717 7.21397 14.5599 6.27901 12.5073 7.8052 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 5.65146 6.72718 4.84679 11.315 10.4072 9.60838 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 8.40971 6.2016 9.45543 6.16078 13.4861 5.83093 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 9.38418 9.52029 17.6365 13.8486 19.111 9.23669 numMergedOcc 0
13 mol 223 unq 0 iso 0 dist 9.03969 6.97426 12.4791 4.68566 12.9079 7.96628 numMergedOcc 0
14 mol 223 unq 1 iso 0 dist 9.03969 8.87456 16.4578 4.68566 12.9079 7.76053 numMergedOcc 0
15 mol 223 unq 2 iso 0 dist 9.03969 8.87456 16.4578 11.1044 19.9956 9.65728 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 9.31156 6.23677 6.16829 8.8161 13.1738 8.96263 numMergedOcc 0
17 mol 250 unq 0 iso 0 dist 9.16575 5.07895 4.24715 5.95822 12.5853 8.59384 numMergedOcc 0
18 mol 255 unq 0 iso 0 dist 7.20562 7.57779 4.80717 12.1115 11.8275 7.16286 numMergedOcc 0
19 mol 280 unq 0 iso 0 dist 6.88553 4.45141 4.68825 5.846 10.04 6.38295 numMergedOcc 0
