0 mol 0 unq 0 iso 0 dist 7.96742 7.19397 12.7706 5.55156 11.962 6.83587 7.16694 14.4281 10.9707 6.94181 numMergedOcc 0
1 mol 0 unq 0 iso 1 dist 7.19397 7.96742 12.7706 5.55156 6.83587 11.962 7.16694 10.9707 14.4281 6.94181 numMergedOcc 0
2 mol 0 unq 1 iso 0 dist 8.24206 6.19218 9.98828 9.5614 13.3337 6.83587 9.40697 12.4868 10.9707 6.94181 numMergedOcc 0
3 mol 0 unq 1 iso 1 dist 6.19218 8.24206 9.98828 9.5614 6.83587 13.3337 9.40697 10.9707 12.4868 6.94181 numMergedOcc 0
4 mol 7 unq 0 iso 0 dist 8.0166 9.32945 5.63739 6.22805 5.70161 4.57188 5.85668 6.0323 10.2084 7.15434 numMergedOcc 0
5 mol 7 unq 0 iso 1 dist 9.32945 8.0166 5.63739 6.22805 4.57188 5.70161 5.85668 10.2084 6.0323 7.15434 numMergedOcc 0
6 mol 7 unq 1 iso 0 dist 8.0166 9.90117 10.2796 6.22805 5.70161 6.09254 5.85668 6.0323 12.9667 7.15434 numMergedOcc 0
7 mol 7 unq 1 iso 1 dist 9.90117 8.0166 10.2796 6.22805 6.09254 5.70161 5.85668 12.9667 6.0323 7.15434 numMergedOcc 0
8 mol 7 unq 1 iso 0 dist 9.32945 9.90117 5.38328 6.22805 4.57188 6.09254 5.85668 10.2084 12.9667 7.15434 numMergedOcc 0
9 mol 7 unq 1 iso 1 dist 9.90117 9.32945 5.38328 6.22805 6.09254 4.57188 5.85668 12.9667 10.2084 7.15434 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 5.39171 9.27355 5.47475 4.24428 8.04817 9.76331 6.13631 7.84699 8.40844 6.10011 numMergedOcc 0
11 mol 73 unq 0 iso 1 dist 9.27355 5.39171 5.47475 4.24428 9.76331 8.04817 6.13631 8.40844 7.84699 6.10011 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 5.39171 9.27355 5.47475 6.30194 5.2774 5.44275 6.13631 7.84699 8.40844 8.124 numMergedOcc 0
13 mol 73 unq 1 iso 1 dist 9.27355 5.39171 5.47475 6.30194 5.44275 5.2774 6.13631 8.40844 7.84699 8.124 numMergedOcc 0
14 mol 73 unq 2 iso 0 dist 5.39171 8.60363 5.05066 4.24428 8.04817 10.4402 6.13631 7.84699 6.99156 6.10011 numMergedOcc 0
15 mol 73 unq 2 iso 1 dist 8.60363 5.39171 5.05066 4.24428 10.4402 8.04817 6.13631 6.99156 7.84699 6.10011 numMergedOcc 0
16 mol 73 unq 3 iso 0 dist 5.39171 8.60363 5.05066 6.30194 5.2774 8.0624 6.13631 7.84699 6.99156 8.124 numMergedOcc 0
17 mol 73 unq 3 iso 1 dist 8.60363 5.39171 5.05066 6.30194 8.0624 5.2774 6.13631 6.99156 7.84699 8.124 numMergedOcc 0
18 mol 73 unq 2 iso 0 dist 9.27355 8.60363 4.4628 4.24428 9.76331 10.4402 6.13631 8.40844 6.99156 6.10011 numMergedOcc 0
19 mol 73 unq 2 iso 1 dist 8.60363 9.27355 4.4628 4.24428 10.4402 9.76331 6.13631 6.99156 8.40844 6.10011 numMergedOcc 0
20 mol 73 unq 3 iso 0 dist 9.27355 8.60363 4.4628 6.30194 5.44275 8.0624 6.13631 8.40844 6.99156 8.124 numMergedOcc 0
21 mol 73 unq 3 iso 1 dist 8.60363 9.27355 4.4628 6.30194 8.0624 5.44275 6.13631 6.99156 8.40844 8.124 numMergedOcc 0
22 mol 75 unq 0 iso 0 dist 7.89636 9.49608 5.34579 7.118 6.33557 9.95193 10.7293 10.7134 15.7928 8.2147 numMergedOcc 0
23 mol 75 unq 0 iso 1 dist 9.49608 7.89636 5.34579 7.118 9.95193 6.33557 10.7293 15.7928 10.7134 8.2147 numMergedOcc 0
24 mol 230 unq 0 iso 0 dist 7.43793 8.4739 5.27013 9.12305 6.87235 9.94041 11.2815 12.0105 13.9136 5.62804 numMergedOcc 0
25 mol 230 unq 0 iso 1 dist 8.4739 7.43793 5.27013 9.12305 9.94041 6.87235 11.2815 13.9136 12.0105 5.62804 numMergedOcc 0
26 mol 230 unq 1 iso 0 dist 7.43793 8.4739 5.27013 9.30906 5.4427 5.52842 11.2815 12.0105 13.9136 9.3619 numMergedOcc 0
27 mol 230 unq 1 iso 1 dist 8.4739 7.43793 5.27013 9.30906 5.52842 5.4427 11.2815 13.9136 12.0105 9.3619 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 6.08181 7.70189 9.86352 9.67877 5.09738 10.4667 16.1624 11.1104 18.7534 8.40766 numMergedOcc 0
29 mol 258 unq 0 iso 1 dist 7.70189 6.08181 9.86352 9.67877 10.4667 5.09738 16.1624 18.7534 11.1104 8.40766 numMergedOcc 0
30 mol 258 unq 1 iso 0 dist 6.08181 7.70189 9.86352 8.81059 13.8694 9.22664 5.79358 10.9114 6.59521 8.21585 numMergedOcc 0
31 mol 258 unq 1 iso 1 dist 7.70189 6.08181 9.86352 8.81059 9.22664 13.8694 5.79358 6.59521 10.9114 8.21585 numMergedOcc 0
32 mol 265 unq 0 iso 0 dist 9.56472 6.5072 10.1588 7.54805 15.4199 12.4903 5.46523 13.9472 11.5573 5.3051 numMergedOcc 0
33 mol 265 unq 0 iso 1 dist 6.5072 9.56472 10.1588 7.54805 12.4903 15.4199 5.46523 11.5573 13.9472 5.3051 numMergedOcc 0
34 mol 265 unq 1 iso 0 dist 9.56472 4.03921 13.1954 7.54805 15.4199 5.11366 5.46523 13.9472 5.10595 5.3051 numMergedOcc 0
35 mol 265 unq 1 iso 1 dist 4.03921 9.56472 13.1954 7.54805 5.11366 15.4199 5.46523 5.10595 13.9472 5.3051 numMergedOcc 0
36 mol 265 unq 1 iso 0 dist 6.5072 4.03921 7.82127 7.54805 12.4903 5.11366 5.46523 11.5573 5.10595 5.3051 numMergedOcc 0
37 mol 265 unq 1 iso 1 dist 4.03921 6.5072 7.82127 7.54805 5.11366 12.4903 5.46523 5.10595 11.5573 5.3051 numMergedOcc 0
38 mol 272 unq 0 iso 0 dist 7.50321 9.61597 5.09845 6.62923 7.55961 5.43733 11.1133 13.3976 11.3096 7.31993 numMergedOcc 0
39 mol 272 unq 0 iso 1 dist 9.61597 7.50321 5.09845 6.62923 5.43733 7.55961 11.1133 11.3096 13.3976 7.31993 numMergedOcc 0
40 mol 274 unq 0 iso 0 dist 9.07452 7.21004 10.3541 6.21831 6.57235 4.97216 6.33183 12.136 5.68643 8.78883 numMergedOcc 0
41 mol 274 unq 0 iso 1 dist 7.21004 9.07452 10.3541 6.21831 4.97216 6.57235 6.33183 5.68643 12.136 8.78883 numMergedOcc 0
42 mol 274 unq 1 iso 0 dist 6.44266 8.75703 10.3541 8.3291 6.57235 4.97216 9.34663 12.136 5.68643 8.78883 numMergedOcc 0
43 mol 274 unq 1 iso 1 dist 8.75703 6.44266 10.3541 8.3291 4.97216 6.57235 9.34663 5.68643 12.136 8.78883 numMergedOcc 0
44 mol 279 unq 0 iso 0 dist 7.319 6.12742 10.8005 9.6147 13.2117 5.34376 5.44699 10.0305 8.36655 8.68797 numMergedOcc 0
45 mol 279 unq 0 iso 1 dist 6.12742 7.319 10.8005 9.6147 5.34376 13.2117 5.44699 8.36655 10.0305 8.68797 numMergedOcc 0
46 mol 279 unq 1 iso 0 dist 7.319 9.45886 12.8532 9.6147 13.2117 10.0132 5.44699 10.0305 13.376 8.68797 numMergedOcc 0
47 mol 279 unq 1 iso 1 dist 9.45886 7.319 12.8532 9.6147 10.0132 13.2117 5.44699 13.376 10.0305 8.68797 numMergedOcc 0
48 mol 279 unq 2 iso 0 dist 5.78017 8.78203 10.71 6.47376 5.34376 5.86731 4.77763 8.36655 10.6842 8.68797 numMergedOcc 0
49 mol 279 unq 2 iso 1 dist 8.78203 5.78017 10.71 6.47376 5.86731 5.34376 4.77763 10.6842 8.36655 8.68797 numMergedOcc 0
50 mol 279 unq 1 iso 0 dist 6.12742 9.45886 5.48262 9.6147 5.34376 10.0132 5.44699 8.36655 13.376 8.68797 numMergedOcc 0
51 mol 279 unq 1 iso 1 dist 9.45886 6.12742 5.48262 9.6147 10.0132 5.34376 5.44699 13.376 8.36655 8.68797 numMergedOcc 0
