0 mol 30 unq 0 iso 0 dist 9.48779 9.93082 6.0015 15.6743 8.7817 12.4936 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 9.48779 9.93082 6.0015 14.7063 7.55415 13.1016 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 5.94235 6.95632 8.75516 4.89959 9.31969 11.6081 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 5.94235 6.95632 8.75516 5.89083 6.54023 12.0246 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.61883 8.6991 9.03289 13.4243 8.85586 12.4089 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 7.61883 8.6991 9.03289 6.00133 5.16364 6.02816 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.14952 8.43309 11.2154 8.19473 8.65802 11.3767 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 9.14952 7.24864 5.8102 8.19473 8.65802 7.52354 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 8.24319 8.95309 5.8102 6.49891 8.65802 7.52354 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 7.2882 6.10988 11.6708 13.0713 8.86329 15.5509 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 7.2882 6.10988 11.6708 11.4089 8.71039 11.8964 numMergedOcc 0
11 mol 131 unq 2 iso 0 dist 7.29431 6.10988 5.66194 12.0685 9.15431 10.8571 numMergedOcc 0
12 mol 131 unq 3 iso 0 dist 7.29431 6.10988 5.66194 11.4089 6.92648 11.8964 numMergedOcc 0
13 mol 131 unq 4 iso 0 dist 7.29431 6.10988 5.66194 15.3289 9.29384 14.9021 numMergedOcc 0
14 mol 131 unq 5 iso 0 dist 5.5811 6.27279 10.8127 9.89836 9.15431 15.7676 numMergedOcc 0
15 mol 131 unq 6 iso 0 dist 5.5811 6.27279 10.8127 6.84632 6.92648 12.6227 numMergedOcc 0
16 mol 131 unq 7 iso 0 dist 5.5811 6.27279 10.8127 6.24204 9.29384 8.70296 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 7.84979 9.34662 9.34112 11.6923 6.76699 6.16242 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.12278 6.90746 5.91678 8.08069 6.72641 10.2534 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 8.2847 6.19843 7.1777 5.42209 5.37446 7.10826 numMergedOcc 0
20 mol 230 unq 0 iso 0 dist 9.64399 9.94373 6.0456 16.0775 9.09271 12.7167 numMergedOcc 0
21 mol 230 unq 1 iso 0 dist 9.64399 9.94373 6.0456 15.033 7.44838 13.0012 numMergedOcc 0
22 mol 240 unq 0 iso 0 dist 8.28101 8.53353 8.23234 15.208 9.47583 15.2806 numMergedOcc 0
23 mol 240 unq 1 iso 0 dist 8.28101 8.53353 8.23234 14.9401 8.44909 15.9329 numMergedOcc 0
24 mol 271 unq 0 iso 0 dist 8.43742 9.34191 8.45001 5.44796 9.29599 9.99864 numMergedOcc 0
25 mol 271 unq 1 iso 0 dist 8.17754 9.34191 14.503 5.8618 9.63775 14.5854 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 6.36266 9.07337 5.43373 7.43608 6.57903 10.5329 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 6.36266 9.07337 5.43373 6.22629 9.65707 11.3516 numMergedOcc 0
28 mol 277 unq 2 iso 0 dist 6.74915 9.07337 7.17477 5.03347 9.3936 12.3547 numMergedOcc 0
29 mol 279 unq 0 iso 0 dist 5.26264 6.06863 5.89415 9.82157 8.29305 13.6219 numMergedOcc 0
30 mol 279 unq 1 iso 0 dist 5.26264 6.06863 5.89415 5.17146 6.43341 9.09855 numMergedOcc 0
