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 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 7.46752 5.66097 7.63133 10.8592 10.8455 6.31718 12.558 12.5273 6.92781 5.05803 numMergedOcc 0
2 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 numMergedOcc 0
3 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 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 14.1708 11.0366 5.80928 6.864 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 8.18518 14.1404 8.4674 12.9091 5.80928 4.51865 6.57145 4.54938 7.67038 6.864 numMergedOcc 0
6 mol 19 unq 4 iso 0 dist 8.18518 6.57145 4.54938 12.9091 5.80928 6.864 14.1404 8.4674 7.67038 4.51865 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 6.85331 9.20254 6.86014 10.4452 10.0952 8.86116 12.3729 12.5077 6.44287 8.38394 numMergedOcc 0
8 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 numMergedOcc 0
9 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 numMergedOcc 0
10 mol 60 unq 0 iso 0 dist 8.8058 12.5818 6.43294 17.8366 10.6819 6.65595 14.3334 11.5843 6.54743 8.90863 numMergedOcc 0
11 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 numMergedOcc 0
12 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 numMergedOcc 0
13 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 numMergedOcc 0
14 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 numMergedOcc 0
15 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 numMergedOcc 0
16 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 numMergedOcc 0
17 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 numMergedOcc 0
18 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 numMergedOcc 0
19 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 numMergedOcc 0
20 mol 115 unq 2 iso 0 dist 9.56867 9.97256 6.11741 12.7842 8.02349 9.33865 7.64822 7.88312 7.69052 5.83991 numMergedOcc 0
21 mol 115 unq 3 iso 0 dist 9.56867 7.64822 7.88312 12.7842 8.02349 5.83991 9.97256 6.11741 7.69052 9.33865 numMergedOcc 0
22 mol 115 unq 4 iso 0 dist 8.35604 11.9798 7.11972 16.1591 10.498 6.90986 15.5225 11.8863 5.67807 5.39945 numMergedOcc 0
23 mol 115 unq 5 iso 0 dist 7.83568 11.3906 7.11972 17.2205 10.498 6.90986 16.5877 11.8863 5.67807 5.39945 numMergedOcc 0
24 mol 133 unq 0 iso 0 dist 7.15203 5.38237 7.24514 10.7939 7.6656 9.52634 12.9335 12.0352 9.56949 6.5107 numMergedOcc 0
25 mol 133 unq 1 iso 0 dist 9.89098 8.96845 9.91388 13.5771 6.69554 9.52634 11.5564 9.66421 9.56949 6.5107 numMergedOcc 0
26 mol 133 unq 2 iso 0 dist 9.89098 8.96845 9.91388 12.2343 6.761 7.24514 7.11894 10.0372 6.65743 8.22656 numMergedOcc 0
27 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 numMergedOcc 0
28 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 numMergedOcc 0
29 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 numMergedOcc 0
30 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 numMergedOcc 0
31 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 numMergedOcc 0
32 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 numMergedOcc 0
33 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 numMergedOcc 0
34 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 numMergedOcc 0
35 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 numMergedOcc 0
36 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 numMergedOcc 0
37 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 numMergedOcc 0
38 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 numMergedOcc 0
39 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 numMergedOcc 0
40 mol 181 unq 1 iso 0 dist 9.07833 9.54619 9.09537 11.44 10.1912 5.98885 9.33514 12.9862 5.16002 9.15386 numMergedOcc 0
41 mol 186 unq 0 iso 0 dist 7.45401 6.8549 7.54065 11.5381 5.74635 8.87694 10.3403 10.7914 9.50685 9.09754 numMergedOcc 0
42 mol 206 unq 0 iso 0 dist 8.73396 6.35321 7.7366 11.7176 5.63422 9.774 10.8278 11.1804 10.4 8.02137 numMergedOcc 0
43 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 numMergedOcc 0
44 mol 224 unq 1 iso 0 dist 4.79841 11.4653 8.95269 15.1903 11.5372 5.78342 12.5358 9.99123 5.0744 9.16166 numMergedOcc 0
45 mol 224 unq 2 iso 0 dist 4.79841 11.4653 8.95269 15.1903 11.5372 5.78342 17.0036 14.0676 5.60236 5.81334 numMergedOcc 0
46 mol 224 unq 3 iso 0 dist 7.25658 5.38198 6.65832 10.8312 6.77699 6.60589 9.17439 10.103 5.0744 6.57273 numMergedOcc 0
47 mol 224 unq 4 iso 0 dist 7.25658 5.38198 6.65832 11.1589 11.328 9.16166 9.17439 10.103 5.0744 5.78342 numMergedOcc 0
48 mol 224 unq 5 iso 0 dist 7.25658 5.38198 6.65832 11.1589 11.328 9.16166 7.13322 10.9745 6.91102 5.81334 numMergedOcc 0
49 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 numMergedOcc 0
50 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 numMergedOcc 0
51 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 numMergedOcc 0
52 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 numMergedOcc 0
53 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 numMergedOcc 0
54 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 numMergedOcc 0
55 mol 236 unq 6 iso 0 dist 6.73134 5.27568 8.35971 12.96 14.2337 8.03456 7.77821 11.2141 7.28249 9.81562 numMergedOcc 0
56 mol 236 unq 7 iso 0 dist 6.73134 5.27568 8.35971 10.8312 14.7998 6.84306 7.77821 11.2141 7.28249 7.68742 numMergedOcc 0
57 mol 236 unq 8 iso 0 dist 6.73134 5.27568 8.35971 11.2195 10.7497 9.99038 7.77821 11.2141 7.28249 6.27581 numMergedOcc 0
58 mol 236 unq 9 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 4.88785 7.68742 5.79505 6.84306 numMergedOcc 0
59 mol 236 unq 10 iso 0 dist 6.36941 8.3919 9.81562 9.97357 7.28249 8.03456 10.2557 6.27581 9.90963 9.99038 numMergedOcc 0
60 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 numMergedOcc 0
61 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 numMergedOcc 0
62 mol 236 unq 13 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 8.3919 9.81562 5.79505 8.03456 numMergedOcc 0
63 mol 236 unq 14 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 10.2557 6.27581 11.3368 9.99038 numMergedOcc 0
64 mol 236 unq 15 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 14.6755 13.499 11.8739 9.78037 numMergedOcc 0
65 mol 236 unq 16 iso 0 dist 6.36941 4.88785 7.68742 9.97357 7.28249 6.84306 16.5918 11.2141 14.7998 8.35971 numMergedOcc 0
66 mol 236 unq 17 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 8.3919 9.81562 9.90963 8.03456 numMergedOcc 0
67 mol 236 unq 18 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 4.88785 7.68742 11.3368 6.84306 numMergedOcc 0
68 mol 236 unq 19 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 14.6755 13.499 11.1557 9.78037 numMergedOcc 0
69 mol 236 unq 20 iso 0 dist 6.36941 10.2557 6.27581 9.97357 7.28249 9.99038 16.5918 11.2141 10.7497 8.35971 numMergedOcc 0
70 mol 253 unq 0 iso 0 dist 7.80525 4.84708 7.32223 7.71295 7.25988 8.31064 6.27022 11.6434 8.02948 6.73034 numMergedOcc 0
71 mol 261 unq 0 iso 0 dist 7.15785 6.5875 8.02547 13.1629 10.0727 8.43057 13.7573 14.2688 10.1239 7.73141 numMergedOcc 0
72 mol 261 unq 1 iso 0 dist 9.43169 6.5875 6.05727 13.1629 4.63549 8.43057 13.7573 10.0703 10.1239 7.73141 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 numMergedOcc 0
