0 mol 7 unq 0 iso 0 dist 8.41585 5.99972 12.0193 5.99459 6.88805 6.12483 12.2041 10.5461 11.2662 9.67164 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.41585 9.68596 14.7759 9.87885 12.8323 10.1841 13.2247 12.2333 12.9581 6.1206 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.10621 8.72114 13.8829 9.67164 13.156 5.5683 12.2041 12.2333 10.3148 5.99459 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 9.62879 7.18019 4.36226 9.01112 7.12261 4.1204 10.9495 10.9634 7.03958 6.56356 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 9.62879 7.18019 4.36226 9.01112 7.12261 4.1204 6.23795 12.4058 8.44009 7.62333 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 5.04899 7.45383 7.33728 9.49421 13.6145 9.62058 10.9391 11.9561 6.16347 9.48085 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 5.04899 9.01548 13.9331 9.49421 13.6145 5.38592 10.9391 11.9561 13.8469 9.48085 numMergedOcc 0
7 mol 25 unq 2 iso 0 dist 7.57578 6.16347 9.34396 9.48085 5.18617 9.62058 10.9391 12.7009 7.45383 9.49421 numMergedOcc 0
8 mol 25 unq 3 iso 0 dist 7.57578 7.92503 6.11127 9.48085 5.18617 10.2758 10.9391 12.7009 16.8925 9.49421 numMergedOcc 0
9 mol 25 unq 4 iso 0 dist 7.17969 6.16347 10.8498 9.48085 5.68041 9.62058 10.9391 12.8117 7.45383 9.49421 numMergedOcc 0
10 mol 25 unq 5 iso 0 dist 7.17969 7.92503 5.30154 9.48085 5.68041 10.2758 10.9391 12.8117 16.8925 9.49421 numMergedOcc 0
11 mol 58 unq 0 iso 0 dist 6.62496 5.93884 5.78774 9.22598 9.87158 5.66912 4.81926 6.35756 7.68678 8.96727 numMergedOcc 0
12 mol 58 unq 1 iso 0 dist 6.35756 7.68678 5.78774 8.96727 9.87158 5.66912 4.81926 6.62496 5.93884 9.22598 numMergedOcc 0
13 mol 60 unq 0 iso 0 dist 8.7531 9.90939 7.04075 8.4312 8.62476 5.85676 5.67502 6.43294 10.1323 7.57295 numMergedOcc 0
14 mol 60 unq 1 iso 0 dist 8.7531 9.90939 7.04075 8.4312 8.62476 5.85676 5.00018 11.5843 11.6165 7.48086 numMergedOcc 0
15 mol 72 unq 0 iso 0 dist 8.8178 9.27838 15.434 7.12321 4.27726 14.005 5.36766 12.8385 11.1896 9.74228 numMergedOcc 0
16 mol 72 unq 1 iso 0 dist 8.8178 9.27838 15.434 7.12321 4.27726 14.005 8.24309 9.84449 16.0048 6.21799 numMergedOcc 0
17 mol 72 unq 2 iso 0 dist 9.96708 9.27838 11.6378 7.12321 7.47371 14.005 5.36766 10.8086 11.1896 9.74228 numMergedOcc 0
18 mol 72 unq 3 iso 0 dist 9.96708 9.27838 11.6378 7.12321 7.47371 14.005 8.24309 9.78528 16.0048 6.21799 numMergedOcc 0
19 mol 95 unq 0 iso 0 dist 9.03572 9.49454 13.3662 8.27883 4.99174 15.7954 6.59884 11.5113 15.8861 7.7152 numMergedOcc 0
20 mol 95 unq 1 iso 0 dist 8.83255 9.49454 12.0666 8.27883 8.67311 15.7954 6.59884 12.9844 15.8861 7.7152 numMergedOcc 0
21 mol 95 unq 2 iso 0 dist 8.03644 9.49454 11.4333 8.27883 15.6249 15.7954 6.59884 11.3446 15.8861 7.7152 numMergedOcc 0
22 mol 98 unq 0 iso 0 dist 5.08437 6.7117 7.06961 5.10496 3.9764 3.94967 9.51923 6.48948 9.42961 5.92242 numMergedOcc 0
23 mol 98 unq 1 iso 0 dist 5.08437 6.7117 7.06961 5.10496 3.9764 3.94967 8.40073 6.10456 4.47349 5.2571 numMergedOcc 0
24 mol 98 unq 2 iso 0 dist 5.08437 6.7117 7.06961 5.10496 3.9764 3.94967 10.2427 10.1136 5.65185 8.7497 numMergedOcc 0
25 mol 98 unq 3 iso 0 dist 6.10456 4.47349 7.06961 7.54889 10.4782 3.92737 13.659 17.4071 12.5931 9.64383 numMergedOcc 0
26 mol 98 unq 4 iso 0 dist 6.10456 4.47349 7.06961 7.54889 10.4782 3.92737 5.02887 10.1136 5.65185 7.78931 numMergedOcc 0
27 mol 98 unq 5 iso 0 dist 6.10456 4.47349 7.06961 5.2571 3.9764 3.94967 8.40073 5.08437 6.7117 5.10496 numMergedOcc 0
28 mol 98 unq 6 iso 0 dist 6.10456 4.47349 7.06961 5.2571 3.9764 3.94967 9.42358 6.48948 9.42961 5.92242 numMergedOcc 0
29 mol 98 unq 7 iso 0 dist 6.10456 4.47349 7.06961 5.2571 3.9764 3.94967 5.02887 10.1136 5.65185 8.7497 numMergedOcc 0
30 mol 100 unq 0 iso 0 dist 8.87449 7.80975 7.97897 9.21662 9.39125 12.48 10.8375 16.1937 14.8081 8.91882 numMergedOcc 0
31 mol 119 unq 0 iso 0 dist 8.73993 6.52773 7.20179 7.64052 9.68677 5.37917 9.93257 16.4353 9.87889 8.95212 numMergedOcc 0
32 mol 119 unq 1 iso 0 dist 8.73993 6.52773 7.20179 7.64052 9.68677 5.37917 4.85907 10.3704 9.11344 6.99446 numMergedOcc 0
33 mol 119 unq 2 iso 0 dist 8.73993 9.23858 9.89358 7.64052 9.68677 15.7711 9.93257 16.4353 18.192 8.95212 numMergedOcc 0
34 mol 119 unq 3 iso 0 dist 8.73993 9.23858 9.89358 7.64052 9.68677 15.7711 4.85907 10.3704 12.7677 6.99446 numMergedOcc 0
35 mol 119 unq 4 iso 0 dist 9.87172 9.11344 10.9441 6.99446 6.20019 5.37917 10.9871 13.9919 9.87889 8.95212 numMergedOcc 0
36 mol 119 unq 5 iso 0 dist 9.87172 9.11344 10.9441 6.99446 6.20019 5.37917 4.85907 12.6489 6.52773 7.64052 numMergedOcc 0
37 mol 119 unq 6 iso 0 dist 6.18601 8.00003 10.4376 8.95212 4.39676 12.3661 10.9871 10.1813 13.7362 6.99446 numMergedOcc 0
38 mol 119 unq 7 iso 0 dist 6.18601 8.00003 10.4376 8.95212 4.39676 12.3661 9.93257 9.72413 9.77873 7.64052 numMergedOcc 0
39 mol 133 unq 0 iso 0 dist 7.24514 7.71248 4.34568 8.26547 5.03174 8.88402 5.61668 10.2995 12.4749 9.05342 numMergedOcc 0
40 mol 133 unq 1 iso 0 dist 8.22656 7.71248 10.6025 8.26547 4.88025 8.88402 5.61668 6.82262 12.4749 9.05342 numMergedOcc 0
41 mol 134 unq 0 iso 0 dist 8.94367 6.23142 4.57832 9.33094 7.41373 6.93712 6.81259 9.86662 9.94764 8.69531 numMergedOcc 0
42 mol 134 unq 1 iso 0 dist 6.37586 6.23142 5.29786 9.33094 10.8635 6.93712 6.81259 9.71307 9.94764 8.69531 numMergedOcc 0
43 mol 134 unq 2 iso 0 dist 6.49416 6.23142 5.71679 9.33094 12.3479 6.93712 6.81259 12.5075 9.94764 8.69531 numMergedOcc 0
44 mol 134 unq 3 iso 0 dist 9.86662 9.94764 4.57832 9.1998 12.8086 11.5269 11.6064 15.281 12.1214 6.42772 numMergedOcc 0
45 mol 134 unq 4 iso 0 dist 9.86662 9.94764 4.57832 9.1998 12.8086 11.5269 7.09823 14.0375 15.049 8.70621 numMergedOcc 0
46 mol 134 unq 5 iso 0 dist 9.86662 9.94764 4.57832 8.69531 7.41373 6.93712 6.81259 8.94367 6.23142 9.33094 numMergedOcc 0
47 mol 134 unq 6 iso 0 dist 9.71307 9.94764 5.29786 9.1998 15.0225 11.5269 11.6064 15.6507 12.1214 6.42772 numMergedOcc 0
48 mol 134 unq 7 iso 0 dist 9.71307 9.94764 5.29786 9.1998 15.0225 11.5269 7.09823 15.9508 15.049 8.70621 numMergedOcc 0
49 mol 134 unq 8 iso 0 dist 9.71307 9.94764 5.29786 8.69531 10.8635 6.93712 6.81259 6.37586 6.23142 9.33094 numMergedOcc 0
50 mol 167 unq 0 iso 0 dist 9.87651 9.67741 13.0123 9.2289 12.0033 8.91275 4.70068 12.4733 11.6896 7.68266 numMergedOcc 0
51 mol 167 unq 1 iso 0 dist 9.87651 9.67741 13.0123 9.2289 12.0033 8.91275 10.3445 17.5366 12.8466 7.6616 numMergedOcc 0
52 mol 167 unq 2 iso 0 dist 9.87651 9.67741 13.0123 7.02548 11.6011 5.95858 4.70068 12.4733 11.6896 6.84752 numMergedOcc 0
53 mol 167 unq 3 iso 0 dist 9.87651 9.67741 13.0123 7.02548 11.6011 5.95858 10.3445 17.5366 12.8466 7.86563 numMergedOcc 0
54 mol 181 unq 0 iso 0 dist 9.1374 6.2479 6.6251 9.76212 12.9532 6.39406 6.01247 9.94371 6.22122 8.59874 numMergedOcc 0
55 mol 181 unq 1 iso 0 dist 8.03334 6.2479 7.81713 9.76212 6.50233 6.39406 6.01247 10.9639 6.22122 8.59874 numMergedOcc 0
56 mol 181 unq 2 iso 0 dist 7.81386 5.94469 7.77758 9.01624 5.71898 11.9796 11.5866 9.81747 14.8638 5.05973 numMergedOcc 0
57 mol 181 unq 3 iso 0 dist 7.63312 5.94469 12.5387 9.01624 5.93724 11.9796 11.5866 9.11469 14.8638 5.05973 numMergedOcc 0
58 mol 186 unq 0 iso 0 dist 7.54065 8.73217 11.7429 6.61112 11.0961 4.03697 7.09479 14.4482 10.6519 8.90571 numMergedOcc 0
59 mol 238 unq 0 iso 0 dist 5.72887 9.24557 14.7883 9.72188 7.06793 17.1065 15.7907 14.6111 21.6822 9.12776 numMergedOcc 0
60 mol 259 unq 0 iso 0 dist 8.13497 7.98231 8.41846 9.46361 12.2293 4.10176 6.96053 10.3935 7.08526 6.95511 numMergedOcc 0
61 mol 259 unq 1 iso 0 dist 7.88519 7.98231 8.81835 9.46361 11.6988 4.10176 6.96053 7.46176 7.08526 6.95511 numMergedOcc 0
62 mol 259 unq 2 iso 0 dist 7.46176 7.08526 8.81835 5.85442 10.067 4.47425 9.98105 12.0576 10.4552 6.9899 numMergedOcc 0
63 mol 259 unq 3 iso 0 dist 7.46176 7.08526 8.81835 6.95511 11.6988 4.10176 6.96053 7.88519 7.98231 9.46361 numMergedOcc 0
64 mol 292 unq 0 iso 0 dist 8.2734 7.07965 10.8848 8.38121 14.179 13.8468 11.8061 17.2013 18.2597 9.90967 numMergedOcc 0
