0 mol 2 unq 0 iso 0 dist 9.74371 9.08872 6.23988 5.30739 9.57674 9.9859 14.1709 7.93028 13.2816 11.2848 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 6.04551 6.31161 9.46719 11.3175 7.78475 14.9331 13.0891 9.07969 17.9696 5.61827 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 6.04551 6.31161 9.46719 11.3175 7.78475 14.9331 14.1866 9.61448 18.9958 8.4772 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 6.01454 8.36915 8.29103 10.7098 6.99001 13.0397 12.665 8.94842 16.7433 5.20775 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 6.01454 8.36915 8.29103 10.7098 6.99001 13.0397 14.1985 9.9555 18.0898 8.11954 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 8.14932 6.17846 8.91253 10.713 8.8633 14.0535 8.87081 6.46589 12.7629 3.91131 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 3.87167 7.09393 3.83043 7.14194 9.99691 11.3628 11.6088 9.43916 9.13371 16.8856 numMergedOcc 0
7 mol 184 unq 0 iso 0 dist 9.45847 7.895 17.2664 8.78943 5.0207 15.7817 16.6018 9.16535 23.3435 10.6777 numMergedOcc 0
8 mol 206 unq 0 iso 0 dist 8.63033 8.02214 7.07077 4.77368 6.69623 6.21951 4.61338 5.83021 9.18711 5.70985 numMergedOcc 0
9 mol 206 unq 1 iso 0 dist 8.02214 8.63033 7.07077 4.77368 6.21951 6.69623 4.61338 9.18711 5.83021 5.70985 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 6.24111 8.60412 9.07869 6.15611 8.87054 14.1377 7.28395 9.11574 13.0983 10.1113 numMergedOcc 0
11 mol 210 unq 1 iso 0 dist 9.00343 7.05535 9.07869 10.7435 8.87054 14.1377 7.49477 9.11574 13.0983 10.1113 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 7.25293 9.81136 9.46821 5.30923 7.43301 13.9681 4.47554 5.79617 10.9167 3.91276 numMergedOcc 0
13 mol 223 unq 0 iso 0 dist 7.80764 9.29204 16.0208 10.5593 6.64193 19.6879 8.1388 8.85178 15.6162 10.5752 numMergedOcc 0
14 mol 223 unq 1 iso 0 dist 7.80764 9.29204 16.0208 10.5593 6.64193 19.6879 14.288 9.73123 23.4915 3.86668 numMergedOcc 0
15 mol 223 unq 2 iso 0 dist 7.80764 9.14789 16.2327 10.5593 6.64193 18.5863 8.1388 8.85178 16.4821 10.5752 numMergedOcc 0
16 mol 223 unq 3 iso 0 dist 7.80764 9.14789 16.2327 10.5593 6.64193 18.5863 14.288 9.73123 22.3512 3.86668 numMergedOcc 0
17 mol 223 unq 4 iso 0 dist 7.80764 5.75896 7.12929 10.5593 6.64193 11.867 8.1388 8.85178 5.50267 10.5752 numMergedOcc 0
18 mol 223 unq 5 iso 0 dist 7.80764 5.75896 7.12929 10.5593 6.64193 11.867 14.288 9.73123 15.0085 3.86668 numMergedOcc 0
19 mol 223 unq 6 iso 0 dist 5.75896 9.29204 11.898 5.64061 8.12403 13.2677 8.1388 5.50267 15.6162 6.14747 numMergedOcc 0
20 mol 223 unq 7 iso 0 dist 5.75896 9.14789 13.5741 5.64061 8.12403 12.568 8.1388 5.50267 16.4821 6.14747 numMergedOcc 0
21 mol 223 unq 8 iso 0 dist 5.75896 7.80764 7.12929 5.64061 8.12403 10.0535 8.1388 5.50267 8.85178 6.14747 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 6.58277 9.63694 15.3443 14.2081 9.45876 23.7833 12.6355 9.97206 21.7188 5.4414 numMergedOcc 0
23 mol 266 unq 1 iso 0 dist 8.42706 8.61786 11.4983 16.3962 9.45876 18.6424 16.8963 9.97206 21.027 5.4414 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 8.78203 5.78017 10.71 14.4524 8.16582 17.9117 4.91802 5.8845 8.9352 9.85432 numMergedOcc 0
25 mol 279 unq 1 iso 0 dist 9.98985 7.22295 8.47795 10.2995 6.12347 12.5966 7.38256 5.60922 10.2864 3.70525 numMergedOcc 0
26 mol 279 unq 2 iso 0 dist 9.98985 7.22295 8.47795 5.10287 8.79637 8.88458 7.38256 5.60922 10.2864 5.61412 numMergedOcc 0
