0 mol 0 unq 0 iso 0 dist 9.6994 7.15528 7.19817 9.23213 5.08793 10.4498 12.9149 12.5416 15.8082 8.66548 numMergedOcc 0
1 mol 0 unq 0 iso 1 dist 7.15528 9.6994 7.19817 9.23213 10.4498 5.08793 12.9149 15.8082 12.5416 8.66548 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 6.81627 7.32874 5.47421 8.26899 5.98837 4.55117 6.20618 8.41778 9.97819 7.60018 numMergedOcc 0
3 mol 58 unq 0 iso 1 dist 7.32874 6.81627 5.47421 8.26899 4.55117 5.98837 6.20618 9.97819 8.41778 7.60018 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 6.81627 7.32874 5.47421 8.26899 5.98837 4.55117 5.61579 5.38524 8.69057 7.03126 numMergedOcc 0
5 mol 58 unq 1 iso 1 dist 7.32874 6.81627 5.47421 8.26899 4.55117 5.98837 5.61579 8.69057 5.38524 7.03126 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 6.81627 9.55426 9.7274 8.26899 5.98837 10.3782 6.20618 8.41778 14.4477 7.60018 numMergedOcc 0
7 mol 58 unq 2 iso 1 dist 9.55426 6.81627 9.7274 8.26899 10.3782 5.98837 6.20618 14.4477 8.41778 7.60018 numMergedOcc 0
8 mol 58 unq 3 iso 0 dist 6.81627 9.55426 9.7274 8.26899 5.98837 10.3782 5.61579 5.38524 13.1897 7.03126 numMergedOcc 0
9 mol 58 unq 3 iso 1 dist 9.55426 6.81627 9.7274 8.26899 10.3782 5.98837 5.61579 13.1897 5.38524 7.03126 numMergedOcc 0
10 mol 58 unq 2 iso 0 dist 7.32874 9.55426 5.90225 8.26899 4.55117 10.3782 6.20618 9.97819 14.4477 7.60018 numMergedOcc 0
11 mol 58 unq 2 iso 1 dist 9.55426 7.32874 5.90225 8.26899 10.3782 4.55117 6.20618 14.4477 9.97819 7.60018 numMergedOcc 0
12 mol 58 unq 3 iso 0 dist 7.32874 9.55426 5.90225 8.26899 4.55117 10.3782 5.61579 8.69057 13.1897 7.03126 numMergedOcc 0
13 mol 58 unq 3 iso 1 dist 9.55426 7.32874 5.90225 8.26899 10.3782 4.55117 5.61579 13.1897 8.69057 7.03126 numMergedOcc 0
14 mol 72 unq 0 iso 0 dist 8.8178 9.96708 10.7394 6.77912 12.0644 7.11552 10.0679 16.89 10.7102 9.37102 numMergedOcc 0
15 mol 72 unq 0 iso 1 dist 9.96708 8.8178 10.7394 6.77912 7.11552 12.0644 10.0679 10.7102 16.89 9.37102 numMergedOcc 0
16 mol 72 unq 1 iso 0 dist 8.8178 9.96708 10.7394 6.77912 12.0644 7.11552 5.69391 13.6019 9.55118 5.4605 numMergedOcc 0
17 mol 72 unq 1 iso 1 dist 9.96708 8.8178 10.7394 6.77912 7.11552 12.0644 5.69391 9.55118 13.6019 5.4605 numMergedOcc 0
18 mol 72 unq 2 iso 0 dist 8.8178 9.96708 10.7394 6.77912 12.0644 7.11552 4.03844 12.4827 12.111 6.53824 numMergedOcc 0
19 mol 72 unq 2 iso 1 dist 9.96708 8.8178 10.7394 6.77912 7.11552 12.0644 4.03844 12.111 12.4827 6.53824 numMergedOcc 0
20 mol 72 unq 3 iso 0 dist 9.96708 9.78528 8.24309 7.321 9.0131 6.11922 7.47371 7.12321 6.21799 9.14817 numMergedOcc 0
21 mol 72 unq 3 iso 1 dist 9.78528 9.96708 8.24309 7.321 6.11922 9.0131 7.47371 6.21799 7.12321 9.14817 numMergedOcc 0
22 mol 72 unq 4 iso 0 dist 9.96708 9.78528 8.24309 7.321 9.0131 6.11922 9.67587 9.35457 5.03251 9.76686 numMergedOcc 0
23 mol 72 unq 4 iso 1 dist 9.78528 9.96708 8.24309 7.321 6.11922 9.0131 9.67587 5.03251 9.35457 9.76686 numMergedOcc 0
24 mol 72 unq 5 iso 0 dist 9.96708 9.78528 8.24309 7.321 9.0131 6.11922 7.07356 12.1131 7.66093 9.437 numMergedOcc 0
25 mol 72 unq 5 iso 1 dist 9.78528 9.96708 8.24309 7.321 6.11922 9.0131 7.07356 7.66093 12.1131 9.437 numMergedOcc 0
26 mol 115 unq 0 iso 0 dist 9.33865 6.11741 8.02349 7.64585 10.2377 10.8939 6.95773 6.24825 10.0255 7.65255 numMergedOcc 0
27 mol 115 unq 0 iso 1 dist 6.11741 9.33865 8.02349 7.64585 10.8939 10.2377 6.95773 10.0255 6.24825 7.65255 numMergedOcc 0
28 mol 115 unq 1 iso 0 dist 9.33865 5.83991 7.69052 7.76729 10.7942 10.9739 6.63111 6.39384 9.42082 8.0168 numMergedOcc 0
29 mol 115 unq 1 iso 1 dist 5.83991 9.33865 7.69052 7.76729 10.9739 10.7942 6.63111 9.42082 6.39384 8.0168 numMergedOcc 0
30 mol 117 unq 0 iso 0 dist 9.84395 7.90328 13.1058 6.62561 11.3679 4.91401 7.20875 16.804 8.84018 9.94053 numMergedOcc 0
31 mol 117 unq 0 iso 1 dist 7.90328 9.84395 13.1058 6.62561 4.91401 11.3679 7.20875 8.84018 16.804 9.94053 numMergedOcc 0
32 mol 133 unq 0 iso 0 dist 7.11802 8.00618 8.18495 7.92688 4.68409 12.2037 14.8533 13.5288 20.9604 9.10003 numMergedOcc 0
33 mol 133 unq 0 iso 1 dist 8.00618 7.11802 8.18495 7.92688 12.2037 4.68409 14.8533 20.9604 13.5288 9.10003 numMergedOcc 0
34 mol 175 unq 0 iso 0 dist 9.0018 7.652 7.42466 9.31887 11.0415 5.0384 5.00913 13.6764 10.1305 9.76114 numMergedOcc 0
35 mol 175 unq 0 iso 1 dist 7.652 9.0018 7.42466 9.31887 5.0384 11.0415 5.00913 10.1305 13.6764 9.76114 numMergedOcc 0
36 mol 224 unq 0 iso 0 dist 9.40098 6.61986 9.54151 8.19953 8.64911 10.7113 5.13732 11.2501 8.08349 5.73591 numMergedOcc 0
37 mol 224 unq 0 iso 1 dist 6.61986 9.40098 9.54151 8.19953 10.7113 8.64911 5.13732 8.08349 11.2501 5.73591 numMergedOcc 0
38 mol 227 unq 0 iso 0 dist 7.22101 7.09863 4.39704 8.17891 6.43754 9.13836 4.1511 9.91384 10.3016 7.79951 numMergedOcc 0
39 mol 227 unq 0 iso 1 dist 7.09863 7.22101 4.39704 8.17891 9.13836 6.43754 4.1511 10.3016 9.91384 7.79951 numMergedOcc 0
40 mol 234 unq 0 iso 0 dist 8.34494 6.56247 6.29886 6.25105 10.3337 11.216 5.53885 13.7549 11.1872 7.36208 numMergedOcc 0
41 mol 234 unq 0 iso 1 dist 6.56247 8.34494 6.29886 6.25105 11.216 10.3337 5.53885 11.1872 13.7549 7.36208 numMergedOcc 0
42 mol 234 unq 1 iso 0 dist 8.34494 9.36357 12.1694 6.25105 10.3337 11.4315 5.53885 13.7549 10.5689 7.36208 numMergedOcc 0
43 mol 234 unq 1 iso 1 dist 9.36357 8.34494 12.1694 6.25105 11.4315 10.3337 5.53885 10.5689 13.7549 7.36208 numMergedOcc 0
44 mol 234 unq 1 iso 0 dist 6.56247 9.36357 7.82322 6.25105 11.216 11.4315 5.53885 11.1872 10.5689 7.36208 numMergedOcc 0
45 mol 234 unq 1 iso 1 dist 9.36357 6.56247 7.82322 6.25105 11.4315 11.216 5.53885 10.5689 11.1872 7.36208 numMergedOcc 0
46 mol 234 unq 2 iso 0 dist 9.45496 6.7625 7.82322 9.5707 15.9563 14.4106 3.95629 11.1872 10.5689 8.27411 numMergedOcc 0
47 mol 234 unq 2 iso 1 dist 6.7625 9.45496 7.82322 9.5707 14.4106 15.9563 3.95629 10.5689 11.1872 8.27411 numMergedOcc 0
48 mol 234 unq 3 iso 0 dist 9.45496 6.7625 7.82322 9.5707 15.9563 14.4106 15.9732 20.7134 19.3876 6.96257 numMergedOcc 0
49 mol 234 unq 3 iso 1 dist 6.7625 9.45496 7.82322 9.5707 14.4106 15.9563 15.9732 19.3876 20.7134 6.96257 numMergedOcc 0
50 mol 234 unq 4 iso 0 dist 9.45496 6.7625 7.82322 7.85175 11.216 11.4315 3.95629 11.1872 10.5689 7.36208 numMergedOcc 0
51 mol 234 unq 4 iso 1 dist 6.7625 9.45496 7.82322 7.85175 11.4315 11.216 3.95629 10.5689 11.1872 7.36208 numMergedOcc 0
52 mol 234 unq 5 iso 0 dist 8.41436 8.92474 8.62358 6.16063 11.3297 10.2563 13.1872 17.3846 11.3419 9.11572 numMergedOcc 0
53 mol 234 unq 5 iso 1 dist 8.92474 8.41436 8.62358 6.16063 10.2563 11.3297 13.1872 11.3419 17.3846 9.11572 numMergedOcc 0
54 mol 248 unq 0 iso 0 dist 7.69895 7.21521 5.55137 6.07192 6.48757 5.51827 4.58289 9.05018 9.33962 5.0345 numMergedOcc 0
55 mol 248 unq 0 iso 1 dist 7.21521 7.69895 5.55137 6.07192 5.51827 6.48757 4.58289 9.33962 9.05018 5.0345 numMergedOcc 0
56 mol 248 unq 1 iso 0 dist 7.69895 8.2965 10.8081 6.07192 6.48757 9.29921 4.58289 9.05018 11.4547 5.0345 numMergedOcc 0
57 mol 248 unq 1 iso 1 dist 8.2965 7.69895 10.8081 6.07192 9.29921 6.48757 4.58289 11.4547 9.05018 5.0345 numMergedOcc 0
58 mol 248 unq 1 iso 0 dist 7.21521 8.2965 5.86196 6.07192 5.51827 9.29921 4.58289 9.33962 11.4547 5.0345 numMergedOcc 0
59 mol 248 unq 1 iso 1 dist 8.2965 7.21521 5.86196 6.07192 9.29921 5.51827 4.58289 11.4547 9.33962 5.0345 numMergedOcc 0
60 mol 259 unq 0 iso 0 dist 7.88519 7.84554 4.86771 7.48005 11.6195 11.8736 10.282 14.2242 16.7322 8.84648 numMergedOcc 0
61 mol 259 unq 0 iso 1 dist 7.84554 7.88519 4.86771 7.48005 11.8736 11.6195 10.282 16.7322 14.2242 8.84648 numMergedOcc 0
62 mol 259 unq 1 iso 0 dist 7.88519 7.84554 4.86771 7.48005 11.6195 11.8736 10.067 10.3406 12.8546 6.23661 numMergedOcc 0
63 mol 259 unq 1 iso 1 dist 7.84554 7.88519 4.86771 7.48005 11.8736 11.6195 10.067 12.8546 10.3406 6.23661 numMergedOcc 0
64 mol 259 unq 2 iso 0 dist 7.88519 7.46176 6.96053 7.48005 11.6195 5.79468 10.282 14.2242 11.7465 8.84648 numMergedOcc 0
65 mol 259 unq 2 iso 1 dist 7.46176 7.88519 6.96053 7.48005 5.79468 11.6195 10.282 11.7465 14.2242 8.84648 numMergedOcc 0
66 mol 259 unq 3 iso 0 dist 7.88519 7.46176 6.96053 7.48005 11.6195 5.79468 10.067 10.3406 5.85442 6.23661 numMergedOcc 0
67 mol 259 unq 3 iso 1 dist 7.46176 7.88519 6.96053 7.48005 5.79468 11.6195 10.067 5.85442 10.3406 6.23661 numMergedOcc 0
68 mol 259 unq 4 iso 0 dist 7.88519 9.18903 10.4881 7.48005 11.6195 12.6649 10.282 14.2242 19.0182 8.84648 numMergedOcc 0
69 mol 259 unq 4 iso 1 dist 9.18903 7.88519 10.4881 7.48005 12.6649 11.6195 10.282 19.0182 14.2242 8.84648 numMergedOcc 0
70 mol 259 unq 5 iso 0 dist 7.88519 9.18903 10.4881 7.48005 11.6195 12.6649 10.067 10.3406 16.0301 6.23661 numMergedOcc 0
71 mol 259 unq 5 iso 1 dist 9.18903 7.88519 10.4881 7.48005 12.6649 11.6195 10.067 16.0301 10.3406 6.23661 numMergedOcc 0
72 mol 259 unq 2 iso 0 dist 7.84554 7.46176 7.64658 7.48005 11.8736 5.79468 10.282 16.7322 11.7465 8.84648 numMergedOcc 0
73 mol 259 unq 2 iso 1 dist 7.46176 7.84554 7.64658 7.48005 5.79468 11.8736 10.282 11.7465 16.7322 8.84648 numMergedOcc 0
74 mol 259 unq 3 iso 0 dist 7.84554 7.46176 7.64658 7.48005 11.8736 5.79468 10.067 12.8546 5.85442 6.23661 numMergedOcc 0
75 mol 259 unq 3 iso 1 dist 7.46176 7.84554 7.64658 7.48005 5.79468 11.8736 10.067 5.85442 12.8546 6.23661 numMergedOcc 0
76 mol 259 unq 4 iso 0 dist 7.84554 9.18903 5.87173 7.48005 11.8736 12.6649 10.282 16.7322 19.0182 8.84648 numMergedOcc 0
77 mol 259 unq 4 iso 1 dist 9.18903 7.84554 5.87173 7.48005 12.6649 11.8736 10.282 19.0182 16.7322 8.84648 numMergedOcc 0
78 mol 259 unq 5 iso 0 dist 7.84554 9.18903 5.87173 7.48005 11.8736 12.6649 10.067 12.8546 16.0301 6.23661 numMergedOcc 0
79 mol 259 unq 5 iso 1 dist 9.18903 7.84554 5.87173 7.48005 12.6649 11.8736 10.067 16.0301 12.8546 6.23661 numMergedOcc 0
80 mol 259 unq 4 iso 0 dist 7.46176 9.18903 10.5239 7.48005 5.79468 12.6649 10.282 11.7465 19.0182 8.84648 numMergedOcc 0
81 mol 259 unq 4 iso 1 dist 9.18903 7.46176 10.5239 7.48005 12.6649 5.79468 10.282 19.0182 11.7465 8.84648 numMergedOcc 0
82 mol 259 unq 5 iso 0 dist 7.46176 9.18903 10.5239 7.48005 5.79468 12.6649 10.067 5.85442 16.0301 6.23661 numMergedOcc 0
83 mol 259 unq 5 iso 1 dist 9.18903 7.46176 10.5239 7.48005 12.6649 5.79468 10.067 16.0301 5.85442 6.23661 numMergedOcc 0
