0 mol 16 unq 0 iso 0 dist 8.17898 5.72175 5.05803 10.6491 6.92781 6.31718 12.0005 7.03948 6.2983 5.47769 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.84393 9.01721 7.82074 14.9301 10.3915 8.4674 11.167 10.2708 5.14627 6.20943 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 17.4635 12.6444 10.9543 8.78293 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 6.31174 8.73972 6.55187 8.23643 numMergedOcc 0
4 mol 19 unq 3 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 11.167 10.2708 5.14627 7.82528 numMergedOcc 0
5 mol 19 unq 4 iso 0 dist 8.18518 14.1404 8.4674 12.9091 5.80928 4.51865 10.7817 9.58539 6.74265 8.58657 numMergedOcc 0
6 mol 19 unq 5 iso 0 dist 8.18518 6.57145 4.54938 10.7917 7.34551 7.20519 10.7817 9.58539 5.5841 9.80108 numMergedOcc 0
7 mol 19 unq 6 iso 0 dist 8.18518 6.57145 4.54938 12.9091 5.80928 6.864 10.7817 9.58539 5.5841 8.58657 numMergedOcc 0
8 mol 59 unq 0 iso 0 dist 9.05547 6.34748 6.85766 13.5562 10.0246 7.71095 7.70259 10.6318 5.3525 8.24062 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 6.30194 10.5627 6.19304 10.392 5.4148 9.96396 5.14919 4.65521 7.41074 8.70133 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 5.79954 12.8388 9.96396 10.4766 5.4148 6.19304 13.1044 8.70133 7.41074 4.65521 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 7.01889 15.0744 9.96396 10.997 5.4148 6.19304 15.124 8.70133 7.41074 4.65521 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 9.22376 5.75796 7.47541 9.8682 6.9948 7.97049 13.0379 7.22293 7.98917 9.47876 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 9.22376 3.85308 7.66905 9.8682 6.9948 6.19965 13.0379 7.22293 11.6116 9.47876 numMergedOcc 0
14 mol 100 unq 0 iso 0 dist 9.57498 6.89762 6.45675 10.0165 5.33144 7.47343 16.4991 11.8016 15.209 7.75343 numMergedOcc 0
15 mol 115 unq 0 iso 0 dist 7.44784 7.64822 7.30858 12.7842 10.8507 5.83991 17.9607 17.6696 10.9739 7.76729 numMergedOcc 0
16 mol 115 unq 1 iso 0 dist 7.44784 7.64822 7.30858 9.56867 11.5723 7.88312 7.97477 11.695 11.7126 6.99777 numMergedOcc 0
17 mol 115 unq 2 iso 0 dist 7.44784 7.64822 7.30858 9.56867 11.5723 7.88312 6.58038 10.0603 4.62962 9.14376 numMergedOcc 0
18 mol 115 unq 3 iso 0 dist 9.56867 9.97256 6.11741 12.7842 8.02349 9.33865 17.9607 12.9821 10.7942 7.76729 numMergedOcc 0
19 mol 115 unq 4 iso 0 dist 9.56867 7.64822 7.88312 12.7842 8.02349 5.83991 17.9607 12.9821 10.9739 7.76729 numMergedOcc 0
20 mol 127 unq 0 iso 0 dist 6.65963 10.345 8.14887 8.62711 7.30196 9.30299 13.376 11.7714 4.77464 9.81878 numMergedOcc 0
21 mol 134 unq 0 iso 0 dist 5.67862 9.52819 6.37586 10.738 5.49782 8.94367 6.30187 5.42582 5.41704 8.79571 numMergedOcc 0
22 mol 134 unq 1 iso 0 dist 5.67862 9.52819 6.37586 7.97208 5.00817 6.49416 6.30187 5.42582 5.41704 8.6355 numMergedOcc 0
23 mol 134 unq 2 iso 0 dist 5.67862 12.4156 9.71307 10.738 5.49782 9.86662 6.30187 5.42582 6.17103 8.79571 numMergedOcc 0
24 mol 134 unq 3 iso 0 dist 7.97208 9.52819 6.49416 10.738 8.80819 8.94367 6.30187 8.6355 5.41704 8.79571 numMergedOcc 0
25 mol 134 unq 4 iso 0 dist 7.97208 9.52819 6.49416 5.67862 5.00817 6.37586 6.30187 8.6355 5.41704 5.42582 numMergedOcc 0
26 mol 155 unq 0 iso 0 dist 7.28355 4.8645 6.23493 10.2528 5.71071 7.46303 10.0058 7.16254 6.3845 9.14392 numMergedOcc 0
27 mol 155 unq 1 iso 0 dist 7.28355 4.8645 6.23493 10.2528 5.71071 7.46303 10.5375 9.86313 5.86939 7.51198 numMergedOcc 0
28 mol 175 unq 0 iso 0 dist 6.73365 5.73338 5.6234 12.3723 6.2715 9.0018 16.6698 12.816 11.0415 9.31887 numMergedOcc 0
29 mol 175 unq 1 iso 0 dist 6.73365 12.753 9.92231 12.3723 6.2715 7.652 16.6698 12.816 5.0384 9.31887 numMergedOcc 0
30 mol 175 unq 2 iso 0 dist 9.45659 5.73338 6.57069 12.3723 8.16421 9.0018 16.6698 11.3137 11.0415 9.31887 numMergedOcc 0
31 mol 175 unq 3 iso 0 dist 9.45659 5.73338 6.57069 6.73365 5.35493 5.6234 7.92448 11.5506 5.28109 9.0664 numMergedOcc 0
32 mol 175 unq 4 iso 0 dist 6.6776 13.7028 9.0018 11.1815 7.42466 7.652 10.2578 9.8589 8.22779 7.24908 numMergedOcc 0
33 mol 175 unq 5 iso 0 dist 6.6776 10.4662 5.6234 11.1815 7.42466 9.92231 10.2578 9.8589 10.5631 7.24908 numMergedOcc 0
34 mol 181 unq 0 iso 0 dist 9.07833 9.54619 9.09537 11.44 10.1912 5.98885 14.3497 14.4632 5.86342 6.94688 numMergedOcc 0
35 mol 181 unq 1 iso 0 dist 9.07833 9.54619 9.09537 11.44 10.1912 5.98885 17.3924 15.4777 9.14057 6.71012 numMergedOcc 0
36 mol 181 unq 2 iso 0 dist 9.63295 12.5935 7.63312 13.3844 8.85576 7.81386 11.4382 10.1232 6.7991 4.93785 numMergedOcc 0
37 mol 224 unq 0 iso 0 dist 4.79841 11.4653 8.95269 9.04374 4.70378 6.57273 7.32238 6.67585 5.29877 6.65984 numMergedOcc 0
38 mol 224 unq 1 iso 0 dist 7.25658 5.38198 6.65832 10.8312 6.77699 6.60589 11.4373 11.0097 6.12232 6.65984 numMergedOcc 0
39 mol 236 unq 0 iso 0 dist 9.97357 8.3919 8.03456 6.36941 7.28249 9.81562 11.4732 7.17676 11.8759 5.34718 numMergedOcc 0
40 mol 236 unq 1 iso 0 dist 9.97357 4.88785 6.84306 6.36941 7.28249 7.68742 11.4732 7.17676 11.3552 5.34718 numMergedOcc 0
41 mol 236 unq 2 iso 0 dist 9.97357 10.2557 9.99038 6.36941 7.28249 6.27581 11.4732 7.17676 6.04825 5.34718 numMergedOcc 0
42 mol 236 unq 3 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 11.4732 5.34718 11.8759 7.17676 numMergedOcc 0
43 mol 236 unq 4 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 14.1057 10.5713 9.07822 6.68463 numMergedOcc 0
44 mol 236 unq 5 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 11.4732 5.34718 11.3552 7.17676 numMergedOcc 0
45 mol 236 unq 6 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 14.1057 10.5713 11.6837 6.68463 numMergedOcc 0
46 mol 236 unq 7 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 11.4732 5.34718 6.04825 7.17676 numMergedOcc 0
47 mol 236 unq 8 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 14.1057 10.5713 8.8265 6.68463 numMergedOcc 0
48 mol 272 unq 0 iso 0 dist 4.78812 5.27123 8.33638 6.62923 5.40809 8.46116 6.99865 6.73206 5.63139 9.09992 numMergedOcc 0
49 mol 272 unq 1 iso 0 dist 4.78812 5.27123 8.33638 6.62923 5.40809 8.46116 10.3424 10.1966 8.52877 6.16449 numMergedOcc 0
50 mol 272 unq 2 iso 0 dist 6.62923 5.27123 8.46116 4.78812 5.40809 8.33638 6.99865 9.09992 5.63139 6.73206 numMergedOcc 0
51 mol 282 unq 0 iso 0 dist 8.58671 8.13794 8.04483 11.0247 5.39891 6.33524 4.91806 6.85028 6.3384 7.32347 numMergedOcc 0
52 mol 282 unq 1 iso 0 dist 6.84554 9.67023 8.76532 14.1723 10.0156 8.04483 10.8603 10.4802 6.3384 6.85028 numMergedOcc 0
53 mol 282 unq 2 iso 0 dist 6.84554 9.67023 8.76532 9.51581 4.66602 6.33524 10.8603 10.4802 6.3384 7.32347 numMergedOcc 0
54 mol 282 unq 3 iso 0 dist 9.51581 9.67023 6.33524 14.1723 5.39891 8.04483 10.8603 7.32347 6.3384 6.85028 numMergedOcc 0
