0 mol 9 unq 0 iso 0 dist 8.57077 6.85412 8.27962 9.78006 3.98483 7.98363 5.60154 8.47421 9.29529 8.04924 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.57077 6.33889 11.4878 9.78006 3.98483 10.4204 5.60154 8.47421 7.2199 8.04924 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 7.20519 8.78293 5.31524 6.92532 12.3486 15.1136 5.5841 9.80108 9.95011 11.2198 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 7.20519 8.23643 11.0832 6.92532 12.3486 6.87842 5.5841 9.80108 13.6944 11.2198 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 7.20519 7.82528 10.4988 6.92532 12.3486 6.34272 5.5841 9.80108 10.7418 11.2198 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 6.864 8.78293 11.4401 6.92532 9.47529 15.1136 5.5841 8.58657 9.95011 11.2198 numMergedOcc 0
6 mol 19 unq 4 iso 0 dist 6.864 8.23643 12.3093 6.92532 9.47529 6.87842 5.5841 8.58657 13.6944 11.2198 numMergedOcc 0
7 mol 19 unq 5 iso 0 dist 6.864 7.82528 4.69858 6.92532 9.47529 6.34272 5.5841 8.58657 10.7418 11.2198 numMergedOcc 0
8 mol 26 unq 0 iso 0 dist 8.34347 6.73162 7.23546 8.44506 13.2876 8.13684 11.887 9.16962 15.0652 19.4863 numMergedOcc 0
9 mol 26 unq 1 iso 0 dist 8.34347 9.16962 11.887 5.69955 10.6756 4.80984 7.23546 6.73162 15.0652 12.4188 numMergedOcc 0
10 mol 45 unq 0 iso 0 dist 7.58835 6.34173 5.67689 9.44459 11.6164 5.94047 6.89191 9.20119 8.59109 11.3961 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 7.47343 8.72704 10.1589 9.00544 14.9392 14.6145 15.209 7.75343 16.0363 22.2111 numMergedOcc 0
12 mol 100 unq 1 iso 0 dist 7.47343 8.72704 10.1589 7.12017 12.6602 6.00843 15.209 7.75343 16.0363 19.9317 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 5.83991 8.66155 6.09023 5.72642 6.4497 5.87507 10.9739 7.76729 12.4065 14.0242 numMergedOcc 0
14 mol 115 unq 1 iso 0 dist 6.11741 6.99777 10.8292 5.74857 6.08806 6.03931 4.61908 9.66954 9.9411 9.62857 numMergedOcc 0
15 mol 115 unq 2 iso 0 dist 6.11741 6.99777 10.8292 5.74857 6.08806 6.03931 10.8939 7.64585 17.3282 13.5029 numMergedOcc 0
16 mol 115 unq 3 iso 0 dist 6.11741 9.14376 6.12943 5.74857 6.08806 5.99374 4.61908 9.66954 11.764 9.62857 numMergedOcc 0
17 mol 115 unq 4 iso 0 dist 6.11741 9.14376 6.12943 5.74857 6.08806 5.99374 10.8939 7.64585 12.1188 13.5029 numMergedOcc 0
18 mol 115 unq 5 iso 0 dist 7.88312 8.66155 4.61908 5.72642 7.3094 5.87507 11.7126 6.99777 9.9411 9.9928 numMergedOcc 0
19 mol 115 unq 6 iso 0 dist 7.88312 8.66155 4.61908 5.72642 7.3094 5.87507 4.62962 9.14376 11.764 9.68845 numMergedOcc 0
20 mol 115 unq 7 iso 0 dist 7.88312 6.99777 11.7126 5.74857 7.21418 6.03931 4.61908 8.66155 9.9411 9.62857 numMergedOcc 0
21 mol 115 unq 8 iso 0 dist 7.88312 9.14376 4.62962 5.74857 7.21418 5.99374 4.61908 8.66155 11.764 9.62857 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 5.98885 6.94688 5.86342 6.51749 5.93488 10.4684 5.4601 7.20046 10.5561 7.345 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 5.98885 6.94688 5.86342 6.51749 5.93488 10.4684 10.0524 7.13543 11.7007 9.52987 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 5.98885 6.71012 9.14057 6.51749 5.93488 12.69 5.4601 7.20046 9.94131 7.345 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 5.98885 6.71012 9.14057 6.51749 5.93488 12.69 10.0524 7.13543 12.8673 9.52987 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 9.15386 6.94688 6.80228 6.51749 7.64267 10.4684 8.25067 9.6668 8.20656 11.1398 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 9.15386 6.71012 11.6919 6.51749 7.64267 12.69 8.25067 9.6668 9.40622 11.1398 numMergedOcc 0
28 mol 209 unq 0 iso 0 dist 7.56373 9.52027 6.43758 8.41195 4.90038 9.02883 7.19056 7.95911 11.5217 11.4242 numMergedOcc 0
29 mol 214 unq 0 iso 0 dist 8.85478 6.97182 8.47007 6.38157 5.63388 9.26037 6.67959 7.46831 11.7443 5.10114 numMergedOcc 0
30 mol 214 unq 1 iso 0 dist 8.85478 6.1175 12.8334 6.38157 5.63388 11.353 6.67959 7.46831 12.7646 5.10114 numMergedOcc 0
31 mol 248 unq 0 iso 0 dist 7.69895 8.50864 10.1857 6.17052 5.99459 6.53154 6.48757 6.07192 13.4404 8.53148 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 5.30224 6.77938 4.99891 8.59697 7.31951 12.1218 5.31048 8.37865 11.4462 6.39918 numMergedOcc 0
33 mol 259 unq 1 iso 0 dist 5.30224 7.76676 5.32839 8.59697 7.31951 9.22203 5.31048 8.37865 9.64797 6.39918 numMergedOcc 0
