0 mol 0 unq 0 iso 0 dist 7.96742 5.55156 11.962 7.16694 14.4281 6.94181 13.7584 17.1626 14.0556 9.94618 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.24206 9.5614 13.3337 9.40697 12.4868 6.94181 18.3338 22.2964 14.0556 9.94618 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.19218 9.5614 6.83587 9.40697 10.9707 6.94181 18.3338 19.7867 14.0556 9.94618 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.19397 5.55156 6.83587 7.16694 10.9707 6.94181 13.7584 19.7867 14.0556 9.94618 numMergedOcc 0
4 mol 7 unq 0 iso 0 dist 9.32945 6.22805 4.57188 5.85668 10.2084 7.15434 8.0166 5.63739 5.70161 6.0323 numMergedOcc 0
5 mol 7 unq 1 iso 0 dist 9.90117 6.22805 6.09254 5.85668 12.9667 7.15434 8.0166 10.2796 5.70161 6.0323 numMergedOcc 0
6 mol 16 unq 0 iso 0 dist 9.31149 9.04834 9.14256 9.19152 14.0866 6.28033 14.0448 14.1984 5.59769 7.72142 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 5.39171 4.24428 8.04817 6.13631 7.84699 6.10011 9.27355 5.47475 9.76331 8.40844 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 5.39171 4.24428 8.04817 6.13631 7.84699 6.10011 8.60363 5.05066 10.4402 6.99156 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 5.39171 6.30194 5.2774 6.13631 7.84699 8.124 9.27355 5.47475 5.44275 8.40844 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 5.39171 6.30194 5.2774 6.13631 7.84699 8.124 8.60363 5.05066 8.0624 6.99156 numMergedOcc 0
11 mol 73 unq 4 iso 0 dist 9.27355 4.24428 9.76331 6.13631 8.40844 6.10011 5.39171 5.47475 8.04817 7.84699 numMergedOcc 0
12 mol 73 unq 5 iso 0 dist 9.27355 4.24428 9.76331 6.13631 8.40844 6.10011 8.60363 4.4628 10.4402 6.99156 numMergedOcc 0
13 mol 73 unq 6 iso 0 dist 9.27355 6.30194 5.44275 6.13631 8.40844 8.124 5.39171 5.47475 5.2774 7.84699 numMergedOcc 0
14 mol 73 unq 7 iso 0 dist 9.27355 6.30194 5.44275 6.13631 8.40844 8.124 8.60363 4.4628 8.0624 6.99156 numMergedOcc 0
15 mol 73 unq 8 iso 0 dist 8.60363 4.24428 10.4402 6.13631 6.99156 6.10011 5.39171 5.05066 8.04817 7.84699 numMergedOcc 0
16 mol 73 unq 9 iso 0 dist 8.60363 4.24428 10.4402 6.13631 6.99156 6.10011 9.27355 4.4628 9.76331 8.40844 numMergedOcc 0
17 mol 73 unq 10 iso 0 dist 8.60363 6.30194 8.0624 6.13631 6.99156 8.124 5.39171 5.05066 5.2774 7.84699 numMergedOcc 0
18 mol 73 unq 11 iso 0 dist 8.60363 6.30194 8.0624 6.13631 6.99156 8.124 9.27355 4.4628 5.44275 8.40844 numMergedOcc 0
19 mol 75 unq 0 iso 0 dist 7.89636 7.118 6.33557 10.7293 10.7134 8.2147 11.5758 6.63829 5.4217 8.47302 numMergedOcc 0
20 mol 75 unq 1 iso 0 dist 9.49608 7.118 9.95193 10.7293 15.7928 8.2147 11.5758 11.1655 5.4217 8.47302 numMergedOcc 0
21 mol 140 unq 0 iso 0 dist 9.92335 9.41832 8.78908 12.2179 15.6916 9.68229 21.5261 24.1711 16.7631 9.74209 numMergedOcc 0
22 mol 230 unq 0 iso 0 dist 6.88683 8.33847 6.87235 11.8106 12.0105 5.62804 13.8632 13.8615 7.07028 5.00735 numMergedOcc 0
23 mol 230 unq 1 iso 0 dist 6.88683 8.33847 6.87235 11.8106 12.0105 5.62804 13.4503 10.8111 5.26217 6.73755 numMergedOcc 0
24 mol 230 unq 2 iso 0 dist 7.43793 9.12305 6.87235 11.2815 12.0105 5.62804 15.0878 13.8615 7.07028 5.00735 numMergedOcc 0
25 mol 230 unq 3 iso 0 dist 7.43793 9.12305 6.87235 11.2815 12.0105 5.62804 14.1175 10.8111 5.26217 6.73755 numMergedOcc 0
26 mol 230 unq 4 iso 0 dist 7.43793 9.30906 5.4427 11.2815 12.0105 9.3619 15.0878 13.8615 11.491 5.00735 numMergedOcc 0
27 mol 230 unq 5 iso 0 dist 7.43793 9.30906 5.4427 11.2815 12.0105 9.3619 14.1175 10.8111 7.46522 6.73755 numMergedOcc 0
28 mol 230 unq 6 iso 0 dist 8.4739 9.12305 9.94041 11.2815 13.9136 5.62804 15.0878 16.6773 7.07028 5.00735 numMergedOcc 0
29 mol 230 unq 7 iso 0 dist 8.4739 9.12305 9.94041 11.2815 13.9136 5.62804 14.1175 12.9421 5.26217 6.73755 numMergedOcc 0
30 mol 230 unq 8 iso 0 dist 8.4739 9.30906 5.52842 11.2815 13.9136 9.3619 15.0878 16.6773 11.491 5.00735 numMergedOcc 0
31 mol 230 unq 9 iso 0 dist 8.4739 9.30906 5.52842 11.2815 13.9136 9.3619 14.1175 12.9421 7.46522 6.73755 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 8.34832 9.27989 11.4465 9.44182 12.5656 6.83046 10.2234 10.5674 5.29737 4.21935 numMergedOcc 0
33 mol 258 unq 0 iso 0 dist 6.08181 9.67877 5.09738 16.1624 11.1104 8.40766 17.1495 11.0806 9.45618 8.34471 numMergedOcc 0
34 mol 258 unq 1 iso 0 dist 6.08181 8.81059 13.8694 5.79358 10.9114 8.21585 7.70189 9.86352 9.22664 6.59521 numMergedOcc 0
35 mol 258 unq 2 iso 0 dist 7.70189 9.67877 10.4667 16.1624 18.7534 8.40766 17.1495 18.5142 9.45618 8.34471 numMergedOcc 0
36 mol 265 unq 0 iso 0 dist 9.56472 7.54805 15.4199 5.46523 13.9472 5.3051 4.03921 13.1954 5.11366 5.10595 numMergedOcc 0
37 mol 265 unq 1 iso 0 dist 6.5072 7.54805 12.4903 5.46523 11.5573 5.3051 4.03921 7.82127 5.11366 5.10595 numMergedOcc 0
38 mol 274 unq 0 iso 0 dist 9.07452 6.21831 6.57235 6.33183 12.136 8.78883 10.3381 14.544 8.19222 8.99974 numMergedOcc 0
39 mol 274 unq 1 iso 0 dist 9.07452 6.21831 6.57235 6.33183 12.136 8.78883 7.21004 10.3541 4.97216 5.68643 numMergedOcc 0
40 mol 274 unq 2 iso 0 dist 9.07452 6.21831 6.57235 6.33183 12.136 8.78883 12.6573 14.1741 10.2686 8.36043 numMergedOcc 0
41 mol 274 unq 3 iso 0 dist 7.21004 6.21831 4.97216 6.33183 5.68643 8.78883 10.3381 4.94221 8.19222 8.99974 numMergedOcc 0
42 mol 274 unq 4 iso 0 dist 7.21004 6.21831 4.97216 6.33183 5.68643 8.78883 12.6573 6.01628 10.2686 8.36043 numMergedOcc 0
43 mol 274 unq 5 iso 0 dist 6.12202 9.81087 7.96313 9.24343 5.59151 5.82876 11.8821 6.07831 12.0757 8.26695 numMergedOcc 0
44 mol 274 unq 6 iso 0 dist 6.12202 9.81087 7.96313 9.24343 5.59151 5.82876 12.988 12.757 7.97998 8.17922 numMergedOcc 0
45 mol 274 unq 7 iso 0 dist 6.44266 8.3291 6.57235 9.34663 12.136 8.78883 13.5853 14.544 8.19222 8.99974 numMergedOcc 0
46 mol 274 unq 8 iso 0 dist 6.44266 8.3291 6.57235 9.34663 12.136 8.78883 8.75703 10.3541 4.97216 5.68643 numMergedOcc 0
47 mol 274 unq 9 iso 0 dist 6.44266 8.3291 6.57235 9.34663 12.136 8.78883 10.0237 14.1741 10.2686 8.36043 numMergedOcc 0
48 mol 274 unq 10 iso 0 dist 8.75703 8.3291 4.97216 9.34663 5.68643 8.78883 13.5853 4.94221 8.19222 8.99974 numMergedOcc 0
49 mol 274 unq 11 iso 0 dist 8.75703 8.3291 4.97216 9.34663 5.68643 8.78883 10.0237 6.01628 10.2686 8.36043 numMergedOcc 0
50 mol 279 unq 0 iso 0 dist 7.319 9.6147 13.2117 5.44699 10.0305 8.68797 6.12742 10.8005 5.34376 8.36655 numMergedOcc 0
51 mol 279 unq 1 iso 0 dist 9.45886 9.6147 10.0132 5.44699 13.376 8.68797 6.12742 5.48262 5.34376 8.36655 numMergedOcc 0
52 mol 279 unq 2 iso 0 dist 8.78203 6.47376 5.86731 4.77763 10.6842 8.68797 5.78017 10.71 5.34376 8.36655 numMergedOcc 0
53 mol 280 unq 0 iso 0 dist 7.3304 8.27417 4.95798 10.5216 9.9227 8.80588 12.9293 11.5166 14.1091 9.047 numMergedOcc 0
