0 mol 11 unq 0 iso 0 dist 9.74528 17.4352 9.81983 11.3059 9.89425 9.74251 15.0022 6.83186 6.51674 12.0683 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.26877 14.2257 7.11491 12.0497 7.78689 8.23404 5.39197 8.22812 11.6319 9.26377 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.26877 14.2257 7.11491 12.0497 7.78689 8.23404 9.53255 4.22002 5.39812 4.88527 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 8.26877 14.2257 7.11491 12.0497 7.78689 8.23404 7.75132 5.77855 8.55482 4.76279 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 8.26877 14.2257 7.11491 12.0497 7.78689 8.23404 14.2848 8.10774 3.59761 5.56357 numMergedOcc 0
5 mol 48 unq 4 iso 0 dist 8.26877 14.2257 7.11491 12.0497 7.78689 8.23404 12.4977 6.5241 3.50984 9.94951 numMergedOcc 0
6 mol 48 unq 5 iso 0 dist 7.99434 11.0398 7.11491 5.76698 7.78689 8.23404 12.2756 8.22812 11.6319 9.26377 numMergedOcc 0
7 mol 48 unq 6 iso 0 dist 7.99434 11.0398 7.11491 5.76698 7.78689 8.23404 8.12843 4.22002 5.39812 4.88527 numMergedOcc 0
8 mol 48 unq 7 iso 0 dist 7.99434 11.0398 7.11491 5.76698 7.78689 8.23404 8.16676 5.77855 8.55482 4.76279 numMergedOcc 0
9 mol 48 unq 8 iso 0 dist 7.99434 11.0398 7.11491 5.76698 7.78689 8.23404 9.72202 8.10774 3.59761 5.56357 numMergedOcc 0
10 mol 48 unq 9 iso 0 dist 7.99434 11.0398 7.11491 5.76698 7.78689 8.23404 12.7252 6.5241 3.50984 9.94951 numMergedOcc 0
11 mol 48 unq 10 iso 0 dist 7.49794 13.7393 7.1829 11.3706 7.70645 8.13327 13.819 8.14245 3.60121 5.43784 numMergedOcc 0
12 mol 48 unq 11 iso 0 dist 7.49794 13.7393 7.1829 11.3706 7.70645 8.13327 11.8742 6.36817 3.65036 9.7018 numMergedOcc 0
13 mol 48 unq 12 iso 0 dist 7.49794 13.7393 7.1829 11.3706 7.70645 8.13327 5.44298 8.0812 11.611 8.95384 numMergedOcc 0
14 mol 48 unq 13 iso 0 dist 7.49794 13.7393 7.1829 11.3706 7.70645 8.13327 9.10301 4.17933 5.37655 4.57947 numMergedOcc 0
15 mol 48 unq 14 iso 0 dist 7.49794 13.7393 7.1829 11.3706 7.70645 8.13327 7.24268 5.54893 8.48119 4.60843 numMergedOcc 0
16 mol 48 unq 15 iso 0 dist 8.10222 11.0408 7.1829 5.75684 7.70645 8.13327 9.57893 8.14245 3.60121 5.43784 numMergedOcc 0
17 mol 48 unq 16 iso 0 dist 8.10222 11.0408 7.1829 5.75684 7.70645 8.13327 12.6437 6.36817 3.65036 9.7018 numMergedOcc 0
18 mol 48 unq 17 iso 0 dist 8.10222 11.0408 7.1829 5.75684 7.70645 8.13327 12.0687 8.0812 11.611 8.95384 numMergedOcc 0
19 mol 48 unq 18 iso 0 dist 8.10222 11.0408 7.1829 5.75684 7.70645 8.13327 7.88988 4.17933 5.37655 4.57947 numMergedOcc 0
20 mol 48 unq 19 iso 0 dist 8.10222 11.0408 7.1829 5.75684 7.70645 8.13327 8.00934 5.54893 8.48119 4.60843 numMergedOcc 0
21 mol 68 unq 0 iso 0 dist 5.26566 7.41059 9.87699 9.4465 8.71074 5.75753 5.08181 7.7485 3.56619 7.18877 numMergedOcc 0
22 mol 79 unq 0 iso 0 dist 4.2253 10.3307 7.38548 5.21981 4.74254 6.0749 8.65653 6.20144 5.79629 7.19532 numMergedOcc 0
23 mol 83 unq 0 iso 0 dist 7.69755 10.4465 8.99451 4.93836 5.35861 10.5584 4.12785 7.50925 8.98065 3.62753 numMergedOcc 0
24 mol 83 unq 1 iso 0 dist 7.69755 10.4465 8.99451 4.93836 5.35861 10.5584 6.83349 6.96722 13.9971 3.65203 numMergedOcc 0
25 mol 83 unq 2 iso 0 dist 9.64197 14.2697 8.99451 8.82563 5.35861 10.5584 9.58199 7.50925 8.98065 3.62753 numMergedOcc 0
26 mol 83 unq 3 iso 0 dist 9.64197 14.2697 8.99451 8.82563 5.35861 10.5584 8.6522 6.96722 13.9971 3.65203 numMergedOcc 0
27 mol 85 unq 0 iso 0 dist 8.66427 6.38363 8.25144 12.4236 5.37869 10.797 11.9441 9.09711 15.6454 11.8779 numMergedOcc 0
28 mol 85 unq 1 iso 0 dist 8.66427 6.38363 8.25144 12.4236 5.37869 10.797 13.8217 7.04244 13.6534 3.65186 numMergedOcc 0
29 mol 85 unq 2 iso 0 dist 8.66427 6.38363 8.25144 12.4236 5.37869 10.797 5.26904 7.07839 9.66391 10.0372 numMergedOcc 0
30 mol 85 unq 3 iso 0 dist 8.66427 6.38363 8.25144 12.4236 5.37869 10.797 9.54731 9.63449 3.93938 12.2971 numMergedOcc 0
31 mol 85 unq 4 iso 0 dist 8.66427 6.38363 8.25144 12.4236 5.37869 10.797 6.77316 7.91193 11.6517 11.7094 numMergedOcc 0
32 mol 85 unq 5 iso 0 dist 8.66427 6.38363 8.25144 9.61831 4.05415 7.04693 11.9441 9.09711 15.6454 12.4835 numMergedOcc 0
33 mol 85 unq 6 iso 0 dist 8.66427 6.38363 8.25144 9.61831 4.05415 7.04693 13.8217 7.04244 13.6534 7.00044 numMergedOcc 0
34 mol 85 unq 7 iso 0 dist 8.66427 6.38363 8.25144 9.61831 4.05415 7.04693 5.26904 7.07839 9.66391 8.78995 numMergedOcc 0
35 mol 85 unq 8 iso 0 dist 8.66427 6.38363 8.25144 9.61831 4.05415 7.04693 9.54731 9.63449 3.93938 8.64367 numMergedOcc 0
36 mol 85 unq 9 iso 0 dist 8.66427 6.38363 8.25144 9.61831 4.05415 7.04693 6.77316 7.91193 11.6517 10.7591 numMergedOcc 0
37 mol 85 unq 10 iso 0 dist 8.66427 6.38363 8.25144 11.3963 9.97944 6.7475 11.9441 9.09711 15.6454 17.9023 numMergedOcc 0
38 mol 85 unq 11 iso 0 dist 8.66427 6.38363 8.25144 11.3963 9.97944 6.7475 13.8217 7.04244 13.6534 16.1804 numMergedOcc 0
39 mol 85 unq 12 iso 0 dist 8.66427 6.38363 8.25144 11.3963 9.97944 6.7475 5.26904 7.07839 9.66391 14.2664 numMergedOcc 0
40 mol 85 unq 13 iso 0 dist 8.66427 6.38363 8.25144 11.3963 9.97944 6.7475 9.54731 9.63449 3.93938 3.21259 numMergedOcc 0
41 mol 85 unq 14 iso 0 dist 8.66427 6.38363 8.25144 11.3963 9.97944 6.7475 6.77316 7.91193 11.6517 15.1209 numMergedOcc 0
42 mol 85 unq 15 iso 0 dist 7.51319 16.5205 9.13593 8.08787 4.29937 10.797 6.90443 6.67137 13.6534 3.65186 numMergedOcc 0
43 mol 85 unq 16 iso 0 dist 7.51319 16.5205 9.13593 8.08787 4.29937 10.797 17.0873 9.78707 3.93938 12.2971 numMergedOcc 0
44 mol 85 unq 17 iso 0 dist 7.51319 16.5205 9.13593 10.4844 3.65628 7.04693 6.90443 6.67137 13.6534 7.00044 numMergedOcc 0
45 mol 85 unq 18 iso 0 dist 7.51319 16.5205 9.13593 10.4844 3.65628 7.04693 17.0873 9.78707 3.93938 8.64367 numMergedOcc 0
46 mol 85 unq 19 iso 0 dist 7.51319 16.5205 9.13593 16.4231 9.77774 6.7475 6.90443 6.67137 13.6534 16.1804 numMergedOcc 0
47 mol 85 unq 20 iso 0 dist 7.51319 16.5205 9.13593 16.4231 9.77774 6.7475 17.0873 9.78707 3.93938 3.21259 numMergedOcc 0
48 mol 85 unq 21 iso 0 dist 8.49887 16.5205 8.25144 8.08787 5.37869 10.797 10.1386 9.09711 15.6454 11.8779 numMergedOcc 0
49 mol 85 unq 22 iso 0 dist 8.49887 16.5205 8.25144 8.08787 5.37869 10.797 6.90443 7.04244 13.6534 3.65186 numMergedOcc 0
50 mol 85 unq 23 iso 0 dist 8.49887 16.5205 8.25144 8.08787 5.37869 10.797 13.5026 7.07839 9.66391 10.0372 numMergedOcc 0
51 mol 85 unq 24 iso 0 dist 8.49887 16.5205 8.25144 8.08787 5.37869 10.797 17.0873 9.63449 3.93938 12.2971 numMergedOcc 0
52 mol 85 unq 25 iso 0 dist 8.49887 16.5205 8.25144 8.08787 5.37869 10.797 13.1772 7.91193 11.6517 11.7094 numMergedOcc 0
53 mol 85 unq 26 iso 0 dist 8.49887 16.5205 8.25144 10.4844 4.05415 7.04693 10.1386 9.09711 15.6454 12.4835 numMergedOcc 0
54 mol 85 unq 27 iso 0 dist 8.49887 16.5205 8.25144 10.4844 4.05415 7.04693 6.90443 7.04244 13.6534 7.00044 numMergedOcc 0
55 mol 85 unq 28 iso 0 dist 8.49887 16.5205 8.25144 10.4844 4.05415 7.04693 13.5026 7.07839 9.66391 8.78995 numMergedOcc 0
56 mol 85 unq 29 iso 0 dist 8.49887 16.5205 8.25144 10.4844 4.05415 7.04693 17.0873 9.63449 3.93938 8.64367 numMergedOcc 0
57 mol 85 unq 30 iso 0 dist 8.49887 16.5205 8.25144 10.4844 4.05415 7.04693 13.1772 7.91193 11.6517 10.7591 numMergedOcc 0
58 mol 85 unq 31 iso 0 dist 8.49887 16.5205 8.25144 16.4231 9.97944 6.7475 10.1386 9.09711 15.6454 17.9023 numMergedOcc 0
59 mol 85 unq 32 iso 0 dist 8.49887 16.5205 8.25144 16.4231 9.97944 6.7475 6.90443 7.04244 13.6534 16.1804 numMergedOcc 0
60 mol 85 unq 33 iso 0 dist 8.49887 16.5205 8.25144 16.4231 9.97944 6.7475 13.5026 7.07839 9.66391 14.2664 numMergedOcc 0
61 mol 85 unq 34 iso 0 dist 8.49887 16.5205 8.25144 16.4231 9.97944 6.7475 17.0873 9.63449 3.93938 3.21259 numMergedOcc 0
62 mol 85 unq 35 iso 0 dist 8.49887 16.5205 8.25144 16.4231 9.97944 6.7475 13.1772 7.91193 11.6517 15.1209 numMergedOcc 0
63 mol 85 unq 36 iso 0 dist 9.43839 6.53627 9.13593 11.053 4.29937 10.797 14.6513 6.67137 13.6534 3.65186 numMergedOcc 0
64 mol 85 unq 37 iso 0 dist 9.43839 6.53627 9.13593 11.053 4.29937 10.797 4.43737 9.78707 3.93938 12.2971 numMergedOcc 0
65 mol 85 unq 38 iso 0 dist 9.43839 6.53627 9.13593 7.97629 3.65628 7.04693 14.6513 6.67137 13.6534 7.00044 numMergedOcc 0
66 mol 85 unq 39 iso 0 dist 9.43839 6.53627 9.13593 7.97629 3.65628 7.04693 4.43737 9.78707 3.93938 8.64367 numMergedOcc 0
67 mol 85 unq 40 iso 0 dist 9.43839 6.53627 9.13593 5.46713 9.77774 6.7475 14.6513 6.67137 13.6534 16.1804 numMergedOcc 0
68 mol 85 unq 41 iso 0 dist 9.43839 6.53627 9.13593 5.46713 9.77774 6.7475 4.43737 9.78707 3.93938 3.21259 numMergedOcc 0
69 mol 143 unq 0 iso 0 dist 9.99012 11.6598 7.2932 12.1494 6.60366 4.06908 11.9534 4.3855 4.5497 5.94217 numMergedOcc 0
70 mol 143 unq 1 iso 0 dist 5.33772 8.28318 7.2932 7.11802 6.60366 4.06908 5.08025 4.3855 4.5497 5.94217 numMergedOcc 0
71 mol 186 unq 0 iso 0 dist 4.79423 9.50013 9.31569 9.5548 8.92135 10.6999 5.86994 7.25595 9.73374 14.4913 numMergedOcc 0
72 mol 186 unq 1 iso 0 dist 4.79423 9.50013 9.31569 9.5548 8.92135 10.6999 8.74892 9.94825 7.47658 5.43612 numMergedOcc 0
73 mol 186 unq 2 iso 0 dist 4.79423 8.59979 8.72743 9.5548 8.92135 6.18065 5.86994 7.25595 14.2269 14.4913 numMergedOcc 0
74 mol 186 unq 3 iso 0 dist 4.79423 8.59979 8.72743 9.5548 8.92135 6.18065 8.74892 9.94825 9.76301 5.43612 numMergedOcc 0
75 mol 254 unq 0 iso 0 dist 9.84028 10.6769 9.31434 8.2786 5.6417 3.91259 11.4342 7.85841 11.0708 8.8967 numMergedOcc 0
76 mol 254 unq 1 iso 0 dist 9.84028 10.6769 9.31434 8.2786 5.6417 3.91259 11.2466 9.20109 13.4911 10.929 numMergedOcc 0
77 mol 254 unq 2 iso 0 dist 9.84028 10.6769 9.31434 5.20737 7.42831 5.53173 11.4342 7.85841 11.0708 9.42679 numMergedOcc 0
78 mol 254 unq 3 iso 0 dist 9.84028 10.6769 9.31434 5.20737 7.42831 5.53173 11.2466 9.20109 13.4911 10.706 numMergedOcc 0
79 mol 285 unq 0 iso 0 dist 4.95596 11.9198 8.79261 5.62841 4.27826 6.3633 4.57431 5.88958 8.78384 3.14843 numMergedOcc 0
80 mol 285 unq 1 iso 0 dist 6.3508 11.9198 9.99125 5.62841 5.82074 6.3633 4.57431 7.78121 8.78384 3.14843 numMergedOcc 0
81 mol 287 unq 0 iso 0 dist 8.17436 13.2009 9.25759 7.94344 4.93516 5.97664 9.08224 4.68668 5.39801 3.66473 numMergedOcc 0
82 mol 288 unq 0 iso 0 dist 8.17436 13.2009 9.25759 7.94344 4.93516 5.97664 9.08224 4.68668 5.39801 3.66473 numMergedOcc 0
83 mol 289 unq 0 iso 0 dist 8.17436 13.2009 9.25759 7.94344 4.93516 5.97664 9.08224 4.68668 5.39801 3.66473 numMergedOcc 0
