0 mol 0 unq 0 iso 0 dist 7.65806 9.72725 6.0225 10.5877 10.5603 5.88757 11.5668 10.5071 5.56852 6.80636 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.65806 9.72725 6.0225 14.2251 10.4406 8.66548 15.3236 9.78068 12.9149 9.23213 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 8.41585 5.99459 6.88805 6.06176 6.36911 8.81608 12.2333 13.2247 13.156 9.36807 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 7.10621 9.67164 13.156 10.515 9.36807 8.81608 10.5461 13.2247 6.88805 6.36911 numMergedOcc 0
4 mol 18 unq 0 iso 0 dist 9.51761 5.65084 12.6536 7.04695 12.3965 5.04478 11.103 14.7832 6.11048 8.52106 numMergedOcc 0
5 mol 18 unq 1 iso 0 dist 9.51761 5.65084 12.6536 7.04695 12.3965 5.04478 9.94539 16.6019 4.52259 6.32451 numMergedOcc 0
6 mol 18 unq 2 iso 0 dist 7.3094 5.65084 9.36767 7.04695 12.8594 5.04478 11.103 12.0722 6.11048 8.52106 numMergedOcc 0
7 mol 18 unq 3 iso 0 dist 7.3094 5.65084 9.36767 7.04695 12.8594 5.04478 9.94539 13.5123 4.52259 6.32451 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 6.81627 5.38524 5.61579 5.98837 8.26899 7.03126 12.0187 7.08557 9.53718 9.33535 numMergedOcc 0
9 mol 58 unq 1 iso 0 dist 7.32874 8.69057 5.61579 4.55117 8.26899 7.03126 10.1508 7.08557 9.53718 9.33535 numMergedOcc 0
10 mol 58 unq 2 iso 0 dist 6.64012 9.08221 4.00553 11.6697 10.5905 8.13051 14.5434 10.026 6.07871 8.81638 numMergedOcc 0
11 mol 58 unq 3 iso 0 dist 9.4099 9.08221 8.55984 11.6697 15.9825 8.13051 14.5434 12.9266 6.07871 8.81638 numMergedOcc 0
12 mol 72 unq 0 iso 0 dist 8.8178 7.12321 4.27726 9.0131 13.3133 9.14817 9.96708 10.7394 7.47371 7.321 numMergedOcc 0
13 mol 72 unq 1 iso 0 dist 9.96708 9.55118 5.69391 7.11552 6.77912 5.4605 10.8086 5.36766 3.94376 8.624 numMergedOcc 0
14 mol 72 unq 2 iso 0 dist 9.78528 9.55118 9.78221 7.11552 11.9814 5.4605 10.8086 7.04035 3.94376 8.624 numMergedOcc 0
15 mol 72 unq 3 iso 0 dist 9.78528 9.55118 9.78221 7.11552 11.9814 5.4605 9.96708 8.24309 5.69391 6.77912 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 7.30858 9.42082 15.3161 10.9739 17.6696 8.0168 5.83991 10.8507 6.63111 7.76729 numMergedOcc 0
17 mol 115 unq 1 iso 0 dist 5.83991 6.24825 6.01673 10.2377 12.2309 7.65255 9.33865 7.69052 6.95773 7.64585 numMergedOcc 0
18 mol 115 unq 2 iso 0 dist 6.11741 6.39384 6.07067 10.7942 12.9821 8.0168 9.33865 8.02349 6.63111 7.76729 numMergedOcc 0
19 mol 115 unq 3 iso 0 dist 7.88312 9.42082 6.07067 10.9739 12.9821 8.0168 5.83991 8.02349 6.63111 7.76729 numMergedOcc 0
20 mol 117 unq 0 iso 0 dist 7.90328 8.84018 7.20875 4.91401 6.62561 9.94053 7.83136 7.22206 3.77029 7.63616 numMergedOcc 0
21 mol 117 unq 1 iso 0 dist 7.83136 8.84018 3.77029 4.91401 7.63616 9.94053 7.90328 7.22206 7.20875 6.62561 numMergedOcc 0
22 mol 117 unq 2 iso 0 dist 7.0603 8.84018 5.21535 4.91401 10.6107 9.94053 7.90328 9.3584 7.20875 6.62561 numMergedOcc 0
23 mol 117 unq 3 iso 0 dist 7.0603 8.84018 5.21535 4.91401 10.6107 9.94053 7.83136 7.21564 3.77029 7.63616 numMergedOcc 0
24 mol 119 unq 0 iso 0 dist 8.73993 7.64052 9.68677 10.0197 14.0269 6.13374 12.6489 12.4603 6.20019 6.19042 numMergedOcc 0
25 mol 119 unq 1 iso 0 dist 8.73993 7.64052 9.68677 10.0197 14.0269 6.13374 9.72413 12.8594 4.39676 8.43904 numMergedOcc 0
26 mol 119 unq 2 iso 0 dist 8.73993 7.64052 9.68677 10.6679 9.63176 9.08536 16.7981 11.6667 14.443 7.39889 numMergedOcc 0
27 mol 119 unq 3 iso 0 dist 8.73993 7.64052 9.68677 10.6679 9.63176 9.08536 12.6489 12.4603 6.20019 7.44174 numMergedOcc 0
28 mol 119 unq 4 iso 0 dist 9.87172 6.99446 6.20019 6.35763 6.19042 6.13374 10.1813 9.22558 4.39676 8.43904 numMergedOcc 0
29 mol 119 unq 5 iso 0 dist 9.87172 6.99446 6.20019 7.36192 7.44174 9.08536 14.5183 11.3169 14.443 7.39889 numMergedOcc 0
30 mol 119 unq 6 iso 0 dist 9.87172 6.99446 6.20019 7.36192 7.44174 9.08536 10.3704 12.4603 9.68677 9.63176 numMergedOcc 0
31 mol 119 unq 7 iso 0 dist 6.18601 8.95212 4.39676 10.3457 8.43904 6.13374 13.9919 9.22558 6.20019 6.19042 numMergedOcc 0
32 mol 119 unq 8 iso 0 dist 6.18601 8.95212 4.39676 16.7975 13.4411 9.08536 23.1442 18.5972 14.443 7.39889 numMergedOcc 0
33 mol 119 unq 9 iso 0 dist 6.18601 8.95212 4.39676 16.7975 13.4411 9.08536 16.4353 12.8594 9.68677 9.63176 numMergedOcc 0
34 mol 119 unq 10 iso 0 dist 6.18601 8.95212 4.39676 16.7975 13.4411 9.08536 13.9919 9.22558 6.20019 7.44174 numMergedOcc 0
35 mol 143 unq 0 iso 0 dist 5.99315 7.36975 13.1926 6.01455 9.27292 7.05845 10.6877 14.4073 7.63293 7.31468 numMergedOcc 0
36 mol 143 unq 1 iso 0 dist 5.99315 7.36975 13.1926 6.01455 9.27292 7.05845 12.7524 14.5751 11.903 7.7056 numMergedOcc 0
37 mol 155 unq 0 iso 0 dist 7.46303 8.97626 9.16779 12.8482 15.9495 7.29911 6.43582 7.66392 4.91785 9.38946 numMergedOcc 0
38 mol 155 unq 1 iso 0 dist 7.46303 8.97626 9.16779 8.27726 12.1081 5.36254 10.7829 10.7349 7.10286 7.39644 numMergedOcc 0
39 mol 155 unq 2 iso 0 dist 7.46303 8.97626 9.16779 8.27726 12.1081 5.36254 6.43582 7.66392 4.91785 7.36102 numMergedOcc 0
40 mol 155 unq 3 iso 0 dist 6.43582 8.97626 4.91785 8.27726 7.36102 5.36254 10.7829 10.7616 7.10286 7.39644 numMergedOcc 0
41 mol 181 unq 0 iso 0 dist 7.63312 6.64173 10.6474 6.7991 10.1232 9.09234 7.81386 8.85576 6.8757 4.93785 numMergedOcc 0
42 mol 181 unq 1 iso 0 dist 7.63312 9.01624 5.93724 6.7991 10.1232 6.76746 7.81386 8.85576 5.71898 4.93785 numMergedOcc 0
43 mol 181 unq 2 iso 0 dist 7.63312 9.55105 5.12833 6.7991 10.1232 8.92098 7.81386 8.85576 5.83796 4.93785 numMergedOcc 0
44 mol 214 unq 0 iso 0 dist 9.65138 7.46481 11.4955 6.67959 10.852 8.70987 8.85478 4.40923 11.1534 7.46831 numMergedOcc 0
45 mol 214 unq 1 iso 0 dist 9.65138 7.46481 11.4955 6.67959 10.852 8.70987 11.9355 12.1198 7.19184 8.60247 numMergedOcc 0
46 mol 214 unq 2 iso 0 dist 7.14453 7.46481 8.459 6.67959 12.6888 8.70987 8.85478 11.3796 11.1534 7.46831 numMergedOcc 0
47 mol 214 unq 3 iso 0 dist 7.14453 7.46481 8.459 6.67959 12.6888 8.70987 11.9355 14.0682 7.19184 8.60247 numMergedOcc 0
48 mol 214 unq 4 iso 0 dist 8.85478 7.46481 11.1534 6.67959 7.46831 8.70987 11.9355 10.3105 7.19184 8.60247 numMergedOcc 0
49 mol 234 unq 0 iso 0 dist 9.45496 7.81215 12.4252 5.56749 15.004 9.11572 10.3625 19.022 13.1872 6.16063 numMergedOcc 0
50 mol 234 unq 1 iso 0 dist 6.7625 7.81215 5.75498 5.56749 10.8628 9.11572 10.3625 16.0265 13.1872 6.16063 numMergedOcc 0
51 mol 238 unq 0 iso 0 dist 6.22714 9.08509 12.7938 5.17471 7.49471 5.43613 7.31233 5.34096 11.0772 7.19008 numMergedOcc 0
52 mol 238 unq 1 iso 0 dist 7.31233 9.08509 11.0772 5.17471 7.19008 5.43613 6.22714 5.34096 12.7938 7.49471 numMergedOcc 0
53 mol 259 unq 0 iso 0 dist 7.46176 5.85442 10.067 5.79468 7.48005 6.23661 11.858 12.5353 7.09907 8.37865 numMergedOcc 0
54 mol 259 unq 1 iso 0 dist 5.30224 8.03219 4.04513 5.31048 8.37865 8.84648 12.0576 12.5353 10.282 7.48005 numMergedOcc 0
55 mol 259 unq 2 iso 0 dist 5.30224 6.9899 7.09907 5.31048 8.37865 6.23661 12.0576 12.5353 10.067 7.48005 numMergedOcc 0
