0 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 7.15287 13.8674 8.41585 5.13744 10.2446 6.36911 6.06176 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.31149 8.17898 7.59626 5.72175 10.6144 5.05803 12.0005 14.2613 7.03948 6.2983 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 9.3147 7.84393 10.5285 9.01721 13.1233 7.82074 6.31174 14.6162 8.73972 6.55187 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 9.79426 7.84393 9.84922 9.01721 13.8602 7.82074 6.31174 9.04865 8.73972 6.55187 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.3473 9.10915 9.82646 9.73304 16.6744 9.67592 12.9814 17.231 8.68586 5.3948 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 8.14932 8.66921 9.82646 10.8918 16.6744 9.67592 11.75 17.231 8.68586 5.3948 numMergedOcc 0
6 mol 64 unq 2 iso 0 dist 6.17846 8.66921 5.33496 10.8918 11.6303 9.67592 11.75 9.82635 8.68586 5.3948 numMergedOcc 0
7 mol 64 unq 3 iso 0 dist 6.08228 5.54343 5.33496 5.59762 11.6303 9.67592 5.68492 9.82635 8.68586 5.3948 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 5.39171 4.24428 8.04817 6.58444 11.905 5.93252 5.14919 6.4154 5.64598 9.77992 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 5.39171 6.30194 5.2774 10.5627 6.89722 6.19304 5.14919 6.4154 4.65521 7.41074 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 9.27355 4.24428 9.76331 6.58444 14.8258 5.93252 5.14919 9.51458 5.64598 9.77992 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 9.27355 6.30194 5.44275 10.5627 7.26679 6.19304 5.14919 9.51458 4.65521 7.41074 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 8.60363 4.24428 10.4402 6.58444 14.0323 5.93252 5.14919 10.9127 5.64598 9.77992 numMergedOcc 0
13 mol 73 unq 5 iso 0 dist 8.60363 6.30194 8.0624 10.5627 10.1503 6.19304 5.14919 10.9127 4.65521 7.41074 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 8.24549 6.85677 5.19198 4.99061 6.49205 6.18601 9.87733 13.9827 9.80862 9.35964 numMergedOcc 0
15 mol 119 unq 1 iso 0 dist 8.24549 6.85677 5.19198 4.99061 6.49205 6.18601 11.7378 12.9568 8.43904 10.3457 numMergedOcc 0
16 mol 127 unq 0 iso 0 dist 8.98151 8.62711 6.75619 10.345 12.4667 9.30299 13.376 14.869 9.81878 4.77464 numMergedOcc 0
17 mol 130 unq 0 iso 0 dist 7.9663 9.05626 9.97628 7.09664 12.0527 8.70949 5.53247 10.7605 6.89257 8.84655 numMergedOcc 0
18 mol 130 unq 1 iso 0 dist 7.9663 9.05626 9.97628 7.09664 12.0527 8.70949 8.63186 15.0759 8.74308 6.76754 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 8.6609 6.73365 6.15969 5.73338 10.7272 5.6234 7.92448 12.2829 9.0664 5.28109 numMergedOcc 0
20 mol 175 unq 1 iso 0 dist 8.6609 6.73365 6.15969 12.753 14.7648 9.92231 7.92448 12.2829 9.0664 7.14477 numMergedOcc 0
21 mol 175 unq 2 iso 0 dist 6.21546 6.73365 5.50014 5.73338 8.69888 5.6234 7.92448 12.616 9.0664 5.28109 numMergedOcc 0
22 mol 175 unq 3 iso 0 dist 6.21546 6.73365 5.50014 12.753 14.9263 9.92231 7.92448 12.616 9.0664 7.14477 numMergedOcc 0
23 mol 175 unq 4 iso 0 dist 6.03184 6.73365 7.28617 5.73338 5.08206 5.6234 7.92448 9.95921 9.0664 5.28109 numMergedOcc 0
24 mol 175 unq 5 iso 0 dist 6.03184 6.73365 7.28617 12.753 11.7895 9.92231 7.92448 9.95921 9.0664 7.14477 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 6.47689 9.63295 5.16386 12.5935 11.5992 7.63312 10.602 10.2559 6.93764 4.80231 numMergedOcc 0
26 mol 220 unq 0 iso 0 dist 7.86207 8.9077 4.90657 10.6943 9.8711 9.23153 10.4277 10.4686 6.84247 6.7067 numMergedOcc 0
27 mol 220 unq 1 iso 0 dist 7.86207 8.9077 4.90657 10.6943 9.8711 9.23153 12.6281 10.0817 6.99002 15.9568 numMergedOcc 0
28 mol 220 unq 2 iso 0 dist 7.86207 8.9077 4.90657 15.396 12.6756 8.24498 10.4277 10.4686 6.84247 6.05129 numMergedOcc 0
29 mol 220 unq 3 iso 0 dist 7.86207 8.9077 4.90657 15.396 12.6756 8.24498 12.6281 10.0817 6.99002 11.1321 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 6.6537 7.04127 6.46679 11.7724 14.4547 9.40098 9.20195 9.04427 8.19953 8.64911 numMergedOcc 0
31 mol 224 unq 1 iso 0 dist 6.6537 7.04127 6.46679 4.55824 9.75313 6.61986 9.20195 9.04427 8.19953 10.7113 numMergedOcc 0
32 mol 224 unq 2 iso 0 dist 9.08719 7.04127 7.85135 11.7724 13.1222 9.40098 9.20195 15.1149 8.19953 8.64911 numMergedOcc 0
33 mol 224 unq 3 iso 0 dist 9.08719 7.04127 7.85135 4.55824 6.08709 6.61986 9.20195 15.1149 8.19953 10.7113 numMergedOcc 0
34 mol 224 unq 4 iso 0 dist 7.62593 4.79841 5.41021 11.4653 9.33771 8.95269 5.64308 10.8214 7.06793 9.36098 numMergedOcc 0
35 mol 224 unq 5 iso 0 dist 7.62593 4.79841 5.41021 11.4653 9.33771 8.95269 7.32238 6.4508 6.67585 5.29877 numMergedOcc 0
36 mol 248 unq 0 iso 0 dist 8.11968 6.44967 4.53213 9.48478 8.71859 7.69895 7.99967 12.7138 8.50864 10.1857 numMergedOcc 0
37 mol 253 unq 0 iso 0 dist 9.58767 8.07341 11.4733 16.581 19.9111 9.02271 14.0411 14.7327 7.19465 7.92528 numMergedOcc 0
38 mol 265 unq 0 iso 0 dist 9.56472 7.54805 15.4199 12.5953 15.5946 8.4218 8.3872 13.1262 6.34034 6.43013 numMergedOcc 0
39 mol 265 unq 1 iso 0 dist 6.5072 7.54805 12.4903 12.5953 17.4584 8.4218 8.3872 14.5765 6.34034 6.43013 numMergedOcc 0
40 mol 265 unq 2 iso 0 dist 4.03921 7.54805 5.11366 12.5953 12.3211 8.4218 8.3872 9.01586 6.34034 6.43013 numMergedOcc 0
41 mol 272 unq 0 iso 0 dist 7.50321 4.78812 5.96981 5.27123 12.4617 8.33638 6.99865 12.5113 6.73206 5.63139 numMergedOcc 0
42 mol 272 unq 1 iso 0 dist 7.50321 6.62923 7.55961 11.9042 16.9946 9.97651 6.99865 12.5113 9.09992 10.841 numMergedOcc 0
43 mol 272 unq 2 iso 0 dist 7.50321 6.62923 7.55961 11.9042 16.9946 9.97651 10.3424 13.6844 6.16449 4.72202 numMergedOcc 0
44 mol 272 unq 3 iso 0 dist 7.50321 6.62923 7.55961 5.27123 12.4617 8.46116 6.99865 12.5113 9.09992 5.63139 numMergedOcc 0
45 mol 272 unq 4 iso 0 dist 7.50321 6.62923 7.55961 5.27123 12.4617 8.46116 10.3424 13.6844 6.16449 8.52877 numMergedOcc 0
46 mol 272 unq 5 iso 0 dist 9.61597 4.78812 6.76845 5.27123 13.2205 8.33638 6.99865 12.8442 6.73206 5.63139 numMergedOcc 0
47 mol 272 unq 6 iso 0 dist 9.61597 6.62923 5.43733 11.9042 15.2989 9.97651 6.99865 12.8442 9.09992 10.841 numMergedOcc 0
48 mol 272 unq 7 iso 0 dist 9.61597 6.62923 5.43733 11.9042 15.2989 9.97651 10.3424 11.1067 6.16449 4.72202 numMergedOcc 0
49 mol 272 unq 8 iso 0 dist 9.61597 6.62923 5.43733 5.27123 13.2205 8.46116 6.99865 12.8442 9.09992 5.63139 numMergedOcc 0
50 mol 272 unq 9 iso 0 dist 9.61597 6.62923 5.43733 5.27123 13.2205 8.46116 10.3424 11.1067 6.16449 8.52877 numMergedOcc 0
51 mol 276 unq 0 iso 0 dist 8.14494 5.30976 9.95911 7.38126 15.3786 9.8993 10.4141 17.9035 8.76347 7.54851 numMergedOcc 0
52 mol 276 unq 1 iso 0 dist 8.14494 5.30976 9.95911 6.39319 13.3495 6.87396 10.4141 17.9035 8.76347 6.4102 numMergedOcc 0
53 mol 282 unq 0 iso 0 dist 7.93511 9.51581 5.04235 9.67023 5.67266 6.33524 10.8603 10.0733 7.32347 6.3384 numMergedOcc 0
54 mol 282 unq 1 iso 0 dist 5.62497 8.58671 4.85461 8.13794 9.63346 8.04483 4.91806 5.2527 6.85028 6.3384 numMergedOcc 0
