0 mol 16 unq 0 iso 0 dist 8.17898 5.72175 5.05803 10.6491 6.92781 6.31718 16.2171 12.5273 10.8455 7.63133 12.0005 7.03948 6.2983 5.47769 5.94084 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.84393 9.01721 7.82074 14.9301 10.3915 8.4674 14.1708 11.0366 5.80928 4.51865 11.167 10.2708 5.14627 6.20943 4.69858 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 15.6111 12.1187 7.34551 7.20519 17.4635 12.6444 10.9543 8.78293 5.31524 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 15.6111 12.1187 7.34551 7.20519 6.31174 8.73972 6.55187 8.23643 11.0832 numMergedOcc 0
4 mol 19 unq 3 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 15.6111 12.1187 7.34551 7.20519 11.167 10.2708 5.14627 7.82528 10.4988 numMergedOcc 0
5 mol 19 unq 4 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 14.1708 11.0366 5.80928 6.864 17.4635 12.6444 10.9543 8.78293 11.4401 numMergedOcc 0
6 mol 19 unq 5 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 14.1708 11.0366 5.80928 6.864 6.31174 8.73972 6.55187 8.23643 12.3093 numMergedOcc 0
7 mol 19 unq 6 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 14.1708 11.0366 5.80928 6.864 11.167 10.2708 5.14627 7.82528 4.69858 numMergedOcc 0
8 mol 19 unq 7 iso 0 dist 8.18518 14.1404 8.4674 12.9091 5.80928 4.51865 6.57145 4.54938 7.67038 6.864 10.7817 9.58539 6.74265 8.58657 5.5841 numMergedOcc 0
9 mol 19 unq 8 iso 0 dist 8.18518 6.57145 4.54938 12.9091 5.80928 6.864 14.1404 8.4674 7.67038 4.51865 10.7817 9.58539 5.5841 8.58657 6.74265 numMergedOcc 0
10 mol 59 unq 0 iso 0 dist 9.05547 6.34748 6.85766 13.5562 10.0246 7.71095 17.7062 17.79 12.5396 8.84665 7.70259 10.6318 5.3525 8.24062 11.0387 numMergedOcc 0
11 mol 59 unq 1 iso 0 dist 9.05547 6.34748 6.85766 13.5562 10.0246 7.71095 13.4664 14.0127 8.19458 8.25513 7.70259 10.6318 5.3525 8.24062 9.15805 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 6.30194 10.5627 6.19304 10.392 5.4148 9.96396 10.8067 10.2049 15.7123 9.38498 5.14919 4.65521 7.41074 8.70133 13.4082 numMergedOcc 0
13 mol 73 unq 1 iso 0 dist 6.30194 10.5627 6.19304 10.392 5.4148 9.96396 17.4113 11.6369 12.016 9.75218 5.14919 4.65521 7.41074 8.70133 15.9882 numMergedOcc 0
14 mol 85 unq 0 iso 0 dist 9.22376 5.75796 7.47541 9.8682 6.9948 7.97049 3.85308 7.66905 5.42586 6.19965 13.0379 7.22293 7.98917 9.47876 11.6116 numMergedOcc 0
15 mol 85 unq 1 iso 0 dist 9.22376 3.85308 7.66905 9.8682 6.9948 6.19965 5.75796 7.47541 5.42586 7.97049 13.0379 7.22293 11.6116 9.47876 7.98917 numMergedOcc 0
16 mol 100 unq 0 iso 0 dist 9.57498 6.89762 6.45675 10.0165 5.33144 7.47343 7.225 10.1409 8.8807 6.65086 16.4991 11.8016 15.209 7.75343 10.9608 numMergedOcc 0
17 mol 100 unq 1 iso 0 dist 9.57498 6.89762 6.45675 10.0165 5.33144 7.47343 14.3348 11.8665 12.6515 6.56369 16.4991 11.8016 15.209 7.75343 5.69137 numMergedOcc 0
18 mol 100 unq 2 iso 0 dist 9.57498 6.89762 6.45675 10.0165 5.33144 7.47343 12.3318 13.912 13.887 9.30209 16.4991 11.8016 15.209 7.75343 9.21622 numMergedOcc 0
19 mol 115 unq 0 iso 0 dist 7.44784 7.64822 7.30858 12.7842 10.8507 5.83991 9.97256 13.8473 7.69052 9.33865 17.9607 17.6696 10.9739 7.76729 10.7942 numMergedOcc 0
20 mol 115 unq 1 iso 0 dist 7.44784 7.64822 7.30858 9.56867 11.5723 7.88312 9.97256 13.8473 7.69052 6.11741 7.97477 11.695 11.7126 6.99777 10.8292 numMergedOcc 0
21 mol 115 unq 2 iso 0 dist 7.44784 7.64822 7.30858 9.56867 11.5723 7.88312 9.97256 13.8473 7.69052 6.11741 6.58038 10.0603 4.62962 9.14376 6.12943 numMergedOcc 0
22 mol 115 unq 3 iso 0 dist 9.56867 9.97256 6.11741 12.7842 8.02349 9.33865 7.64822 7.88312 7.69052 5.83991 17.9607 12.9821 10.7942 7.76729 10.9739 numMergedOcc 0
23 mol 115 unq 4 iso 0 dist 9.56867 7.64822 7.88312 12.7842 8.02349 5.83991 9.97256 6.11741 7.69052 9.33865 17.9607 12.9821 10.9739 7.76729 10.7942 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 5.67862 9.52819 6.37586 10.738 5.49782 8.94367 12.4156 9.71307 6.81259 9.86662 6.30187 5.42582 5.41704 8.79571 6.17103 numMergedOcc 0
25 mol 134 unq 1 iso 0 dist 5.67862 9.52819 6.37586 7.97208 5.00817 6.49416 12.5576 9.5126 5.00526 6.54501 6.30187 5.42582 5.41704 8.6355 10.1448 numMergedOcc 0
26 mol 134 unq 2 iso 0 dist 5.67862 12.4156 9.71307 10.738 5.49782 9.86662 9.52819 6.37586 6.81259 8.94367 6.30187 5.42582 6.17103 8.79571 5.41704 numMergedOcc 0
27 mol 134 unq 3 iso 0 dist 7.97208 9.52819 6.49416 10.738 8.80819 8.94367 12.4156 12.5075 6.81259 9.86662 6.30187 8.6355 5.41704 8.79571 6.17103 numMergedOcc 0
28 mol 134 unq 4 iso 0 dist 7.97208 9.52819 6.49416 5.67862 5.00817 6.37586 12.4156 12.5075 6.81259 9.71307 6.30187 8.6355 5.41704 5.42582 6.17103 numMergedOcc 0
29 mol 155 unq 0 iso 0 dist 7.28355 4.8645 6.23493 10.2528 5.71071 7.46303 10.2051 10.2463 7.66392 6.43582 10.0058 7.16254 6.3845 9.14392 12.1814 numMergedOcc 0
30 mol 155 unq 1 iso 0 dist 7.28355 4.8645 6.23493 10.2528 5.71071 7.46303 10.2051 10.2463 7.66392 6.43582 10.5375 9.86313 5.86939 7.51198 6.34186 numMergedOcc 0
31 mol 175 unq 0 iso 0 dist 6.73365 5.73338 5.6234 12.3723 6.2715 9.0018 12.753 9.92231 7.42466 7.652 16.6698 12.816 11.0415 9.31887 5.0384 numMergedOcc 0
32 mol 175 unq 1 iso 0 dist 6.73365 12.753 9.92231 12.3723 6.2715 7.652 5.73338 5.6234 7.42466 9.0018 16.6698 12.816 5.0384 9.31887 11.0415 numMergedOcc 0
33 mol 175 unq 2 iso 0 dist 9.45659 5.73338 6.57069 12.3723 8.16421 9.0018 12.753 10.2623 7.42466 7.652 16.6698 11.3137 11.0415 9.31887 5.0384 numMergedOcc 0
34 mol 175 unq 3 iso 0 dist 9.45659 5.73338 6.57069 6.73365 5.35493 5.6234 12.753 10.2623 7.42466 9.92231 7.92448 11.5506 5.28109 9.0664 7.14477 numMergedOcc 0
35 mol 175 unq 4 iso 0 dist 6.6776 13.7028 9.0018 11.1815 7.42466 7.652 10.4662 5.6234 6.2715 9.92231 10.2578 9.8589 8.22779 7.24908 10.5631 numMergedOcc 0
36 mol 175 unq 5 iso 0 dist 6.6776 10.4662 5.6234 11.1815 7.42466 9.92231 13.7028 9.0018 6.2715 7.652 10.2578 9.8589 10.5631 7.24908 8.22779 numMergedOcc 0
37 mol 181 unq 0 iso 0 dist 9.07833 9.54619 9.09537 11.44 10.1912 5.98885 18.2553 15.0228 8.88798 9.1374 14.3497 14.4632 5.86342 6.94688 6.25083 numMergedOcc 0
38 mol 181 unq 1 iso 0 dist 9.07833 9.54619 9.09537 11.44 10.1912 5.98885 18.2553 15.0228 8.88798 9.1374 17.3924 15.4777 9.14057 6.71012 4.77278 numMergedOcc 0
39 mol 181 unq 2 iso 0 dist 9.07833 9.54619 9.09537 11.44 10.1912 5.98885 9.33514 12.9862 5.16002 9.15386 14.3497 14.4632 5.86342 6.94688 6.80228 numMergedOcc 0
40 mol 181 unq 3 iso 0 dist 9.07833 9.54619 9.09537 11.44 10.1912 5.98885 9.33514 12.9862 5.16002 9.15386 17.3924 15.4777 9.14057 6.71012 11.6919 numMergedOcc 0
41 mol 224 unq 0 iso 0 dist 4.79841 11.4653 8.95269 9.04374 4.70378 6.57273 12.5358 9.99123 5.0744 6.60589 7.32238 6.67585 5.29877 6.65984 6.12232 numMergedOcc 0
42 mol 224 unq 1 iso 0 dist 7.25658 5.38198 6.65832 10.8312 6.77699 6.60589 9.17439 10.103 5.0744 6.57273 11.4373 11.0097 6.12232 6.65984 5.29877 numMergedOcc 0
43 mol 236 unq 0 iso 0 dist 9.97357 8.3919 8.03456 6.36941 7.28249 9.81562 4.88785 6.84306 5.79505 7.68742 11.4732 7.17676 11.8759 5.34718 11.3552 numMergedOcc 0
44 mol 236 unq 1 iso 0 dist 9.97357 8.3919 8.03456 6.36941 7.28249 9.81562 10.2557 9.99038 9.90963 6.27581 11.4732 7.17676 11.8759 5.34718 6.04825 numMergedOcc 0
45 mol 236 unq 2 iso 0 dist 9.97357 4.88785 6.84306 6.36941 7.28249 7.68742 8.3919 8.03456 5.79505 9.81562 11.4732 7.17676 11.3552 5.34718 11.8759 numMergedOcc 0
46 mol 236 unq 3 iso 0 dist 9.97357 4.88785 6.84306 6.36941 7.28249 7.68742 10.2557 9.99038 11.3368 6.27581 11.4732 7.17676 11.3552 5.34718 6.04825 numMergedOcc 0
47 mol 236 unq 4 iso 0 dist 9.97357 10.2557 9.99038 6.36941 7.28249 6.27581 8.3919 8.03456 9.90963 9.81562 11.4732 7.17676 6.04825 5.34718 11.8759 numMergedOcc 0
48 mol 236 unq 5 iso 0 dist 9.97357 10.2557 9.99038 6.36941 7.28249 6.27581 4.88785 6.84306 11.3368 7.68742 11.4732 7.17676 6.04825 5.34718 11.3552 numMergedOcc 0
49 mol 236 unq 6 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 4.88785 7.68742 5.79505 6.84306 11.4732 5.34718 11.8759 7.17676 11.3552 numMergedOcc 0
50 mol 236 unq 7 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 4.88785 7.68742 5.79505 6.84306 14.1057 10.5713 9.07822 6.68463 11.6837 numMergedOcc 0
51 mol 236 unq 8 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 10.2557 6.27581 9.90963 9.99038 11.4732 5.34718 11.8759 7.17676 6.04825 numMergedOcc 0
52 mol 236 unq 9 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 10.2557 6.27581 9.90963 9.99038 14.1057 10.5713 9.07822 6.68463 8.8265 numMergedOcc 0
53 mol 236 unq 10 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 14.6755 13.499 6.96005 9.78037 11.4732 5.34718 11.8759 7.17676 12.6468 numMergedOcc 0
54 mol 236 unq 11 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 14.6755 13.499 6.96005 9.78037 14.1057 10.5713 9.07822 6.68463 5.80136 numMergedOcc 0
55 mol 236 unq 12 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 16.5918 11.2141 14.2337 8.35971 11.4732 5.34718 11.8759 7.17676 6.40312 numMergedOcc 0
56 mol 236 unq 13 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 16.5918 11.2141 14.2337 8.35971 14.1057 10.5713 9.07822 6.68463 6.2568 numMergedOcc 0
57 mol 236 unq 14 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 8.3919 9.81562 5.79505 8.03456 11.4732 5.34718 11.3552 7.17676 11.8759 numMergedOcc 0
58 mol 236 unq 15 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 8.3919 9.81562 5.79505 8.03456 14.1057 10.5713 11.6837 6.68463 9.07822 numMergedOcc 0
59 mol 236 unq 16 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 10.2557 6.27581 11.3368 9.99038 11.4732 5.34718 11.3552 7.17676 6.04825 numMergedOcc 0
60 mol 236 unq 17 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 10.2557 6.27581 11.3368 9.99038 14.1057 10.5713 11.6837 6.68463 8.8265 numMergedOcc 0
61 mol 236 unq 18 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 14.6755 13.499 11.8739 9.78037 11.4732 5.34718 11.3552 7.17676 12.6468 numMergedOcc 0
62 mol 236 unq 19 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 14.6755 13.499 11.8739 9.78037 14.1057 10.5713 11.6837 6.68463 5.80136 numMergedOcc 0
63 mol 236 unq 20 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 16.5918 11.2141 14.7998 8.35971 11.4732 5.34718 11.3552 7.17676 6.40312 numMergedOcc 0
64 mol 236 unq 21 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 16.5918 11.2141 14.7998 8.35971 14.1057 10.5713 11.6837 6.68463 6.2568 numMergedOcc 0
65 mol 236 unq 22 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 8.3919 9.81562 9.90963 8.03456 11.4732 5.34718 6.04825 7.17676 11.8759 numMergedOcc 0
66 mol 236 unq 23 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 8.3919 9.81562 9.90963 8.03456 14.1057 10.5713 8.8265 6.68463 9.07822 numMergedOcc 0
67 mol 236 unq 24 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 4.88785 7.68742 11.3368 6.84306 11.4732 5.34718 6.04825 7.17676 11.3552 numMergedOcc 0
68 mol 236 unq 25 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 4.88785 7.68742 11.3368 6.84306 14.1057 10.5713 8.8265 6.68463 11.6837 numMergedOcc 0
69 mol 236 unq 26 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 14.6755 13.499 11.1557 9.78037 11.4732 5.34718 6.04825 7.17676 12.6468 numMergedOcc 0
70 mol 236 unq 27 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 14.6755 13.499 11.1557 9.78037 14.1057 10.5713 8.8265 6.68463 5.80136 numMergedOcc 0
71 mol 236 unq 28 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 16.5918 11.2141 10.7497 8.35971 11.4732 5.34718 6.04825 7.17676 6.40312 numMergedOcc 0
72 mol 236 unq 29 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 16.5918 11.2141 10.7497 8.35971 14.1057 10.5713 8.8265 6.68463 6.2568 numMergedOcc 0
73 mol 272 unq 0 iso 0 dist 4.78812 5.27123 8.33638 6.62923 5.40809 8.46116 11.9042 13.2494 8.12676 9.97651 6.99865 6.73206 5.63139 9.09992 10.841 numMergedOcc 0
74 mol 272 unq 1 iso 0 dist 4.78812 5.27123 8.33638 6.62923 5.40809 8.46116 11.9042 13.2494 8.12676 9.97651 10.3424 10.1966 8.52877 6.16449 4.72202 numMergedOcc 0
