0 mol 26 unq 0 iso 0 dist 9.97991 11.1182 8.44506 6.81961 9.5053 10.9837 5.21951 6.38243 7.11305 4.76998 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.0534 4.91508 8.03303 14.9324 7.62738 14.6243 11.5328 7.69861 8.96557 13.0054 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 5.89661 8.38283 9.81831 8.64726 7.62611 4.4022 10.5249 7.8435 16.1023 14.9656 numMergedOcc 0
3 mol 93 unq 1 iso 0 dist 5.89661 8.38283 9.81831 8.64726 7.62611 4.4022 10.3971 5.99269 13.1721 11.5397 numMergedOcc 0
4 mol 93 unq 2 iso 0 dist 5.89661 8.38283 9.81831 8.64726 7.62611 4.4022 8.75661 5.71763 9.34182 5.43515 numMergedOcc 0
5 mol 93 unq 3 iso 0 dist 5.89661 6.13065 9.12858 8.64726 7.62611 8.96224 10.5249 7.8435 12.4934 14.9656 numMergedOcc 0
6 mol 93 unq 4 iso 0 dist 5.89661 6.13065 9.12858 8.64726 7.62611 8.96224 10.3971 5.99269 11.0537 11.5397 numMergedOcc 0
7 mol 93 unq 5 iso 0 dist 5.89661 6.13065 9.12858 8.64726 7.62611 8.96224 8.75661 5.71763 12.0103 5.43515 numMergedOcc 0
8 mol 93 unq 6 iso 0 dist 5.89661 11.0971 9.4523 8.64726 7.62611 10.3849 10.5249 7.8435 10.8106 14.9656 numMergedOcc 0
9 mol 93 unq 7 iso 0 dist 5.89661 11.0971 9.4523 8.64726 7.62611 10.3849 10.3971 5.99269 7.14217 11.5397 numMergedOcc 0
10 mol 93 unq 8 iso 0 dist 5.89661 11.0971 9.4523 8.64726 7.62611 10.3849 8.75661 5.71763 12.9351 5.43515 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 9.60416 11.8887 7.26086 17.0061 8.43352 7.06961 15.4506 8.75597 3.9764 3.94967 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 7.20629 4.6251 7.77116 9.25614 8.8562 7.20179 9.24957 9.6121 6.9194 12.8661 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 7.20629 4.6251 7.77116 9.25614 8.8562 7.20179 12.6962 9.57341 9.68677 5.37917 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 7.20629 4.6251 7.77116 5.53673 7.91683 9.89358 9.24957 9.6121 6.9194 13.3563 numMergedOcc 0
15 mol 119 unq 3 iso 0 dist 7.20629 4.6251 7.77116 5.53673 7.91683 9.89358 12.6962 9.57341 9.68677 15.7711 numMergedOcc 0
16 mol 126 unq 0 iso 0 dist 9.31118 5.50061 9.46588 5.23583 5.94233 6.0268 10.1006 8.66815 10.7549 5.50104 numMergedOcc 0
17 mol 126 unq 1 iso 0 dist 9.31118 5.50061 9.46588 11.0459 8.56219 8.01268 10.1006 8.66815 10.7549 7.02562 numMergedOcc 0
18 mol 126 unq 2 iso 0 dist 8.44104 13.2671 9.46588 7.25449 5.94233 6.0268 5.08006 8.66815 10.7549 5.50104 numMergedOcc 0
19 mol 126 unq 3 iso 0 dist 8.44104 13.2671 9.46588 11.2199 8.56219 8.01268 5.08006 8.66815 10.7549 7.02562 numMergedOcc 0
20 mol 130 unq 0 iso 0 dist 7.67321 13.9674 9.28592 15.6039 9.13191 8.01932 11.6 8.24966 8.14075 6.39648 numMergedOcc 0
21 mol 130 unq 1 iso 0 dist 7.67321 13.9674 9.28592 8.90781 6.95405 6.75397 11.6 8.24966 8.14075 10.3272 numMergedOcc 0
22 mol 147 unq 0 iso 0 dist 9.95533 5.65454 5.49226 14.6343 7.25644 11.1681 15.6865 9.43989 12.068 3.88427 numMergedOcc 0
23 mol 147 unq 1 iso 0 dist 9.95533 10.1056 6.28351 14.6343 7.25644 5.50251 15.6865 9.43989 5.59468 3.88427 numMergedOcc 0
24 mol 147 unq 2 iso 0 dist 7.94147 10.4411 5.49226 5.93581 7.25644 11.1681 8.57724 9.43989 12.068 3.88427 numMergedOcc 0
25 mol 147 unq 3 iso 0 dist 7.94147 6.11262 6.28351 5.93581 7.25644 5.50251 8.57724 9.43989 5.59468 3.88427 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 5.31166 5.95114 9.56197 9.11826 7.46987 9.74148 6.3473 8.57801 6.89047 6.18065 numMergedOcc 0
27 mol 186 unq 1 iso 0 dist 5.31166 5.93294 7.24795 9.11826 7.46987 7.30024 6.3473 8.57801 3.90244 6.18065 numMergedOcc 0
28 mol 186 unq 2 iso 0 dist 5.31166 8.88219 8.64409 9.11826 7.46987 11.6919 6.3473 8.57801 12.6058 6.18065 numMergedOcc 0
29 mol 186 unq 3 iso 0 dist 5.31166 7.74823 7.60202 9.11826 7.46987 5.3967 6.3473 8.57801 7.21555 6.18065 numMergedOcc 0
30 mol 222 unq 0 iso 0 dist 7.11989 6.3985 9.2581 10.4275 9.08955 5.89689 11.0888 7.97027 9.01393 4.67663 numMergedOcc 0
31 mol 222 unq 1 iso 0 dist 7.11989 6.3985 9.2581 10.4275 9.08955 5.89689 5.93092 6.81955 6.25425 9.32357 numMergedOcc 0
32 mol 222 unq 2 iso 0 dist 7.11989 6.3985 9.2581 10.4275 9.08955 5.89689 6.80198 4.9876 5.64455 6.37382 numMergedOcc 0
33 mol 222 unq 3 iso 0 dist 7.11989 6.3985 9.2581 9.86636 8.88664 8.92719 11.0888 7.97027 9.01393 4.00869 numMergedOcc 0
34 mol 222 unq 4 iso 0 dist 7.11989 6.3985 9.2581 9.86636 8.88664 8.92719 5.93092 6.81955 6.25425 12.2233 numMergedOcc 0
35 mol 222 unq 5 iso 0 dist 7.11989 6.3985 9.2581 9.86636 8.88664 8.92719 6.80198 4.9876 5.64455 9.60662 numMergedOcc 0
36 mol 222 unq 6 iso 0 dist 7.11989 6.3985 9.2581 5.78833 7.16819 5.82526 11.0888 7.97027 9.01393 6.23984 numMergedOcc 0
37 mol 222 unq 7 iso 0 dist 7.11989 6.3985 9.2581 5.78833 7.16819 5.82526 5.93092 6.81955 6.25425 8.87178 numMergedOcc 0
38 mol 222 unq 8 iso 0 dist 7.11989 6.3985 9.2581 5.78833 7.16819 5.82526 6.80198 4.9876 5.64455 7.13962 numMergedOcc 0
39 mol 222 unq 9 iso 0 dist 7.11989 11.068 9.62632 10.4275 9.08955 10.6944 11.0888 7.97027 13.3586 4.67663 numMergedOcc 0
40 mol 222 unq 10 iso 0 dist 7.11989 11.068 9.62632 10.4275 9.08955 10.6944 5.93092 6.81955 5.16212 9.32357 numMergedOcc 0
41 mol 222 unq 11 iso 0 dist 7.11989 11.068 9.62632 10.4275 9.08955 10.6944 6.80198 4.9876 5.9478 6.37382 numMergedOcc 0
42 mol 222 unq 12 iso 0 dist 7.11989 11.068 9.62632 9.86636 8.88664 15.4372 11.0888 7.97027 13.3586 4.00869 numMergedOcc 0
43 mol 222 unq 13 iso 0 dist 7.11989 11.068 9.62632 9.86636 8.88664 15.4372 5.93092 6.81955 5.16212 12.2233 numMergedOcc 0
44 mol 222 unq 14 iso 0 dist 7.11989 11.068 9.62632 9.86636 8.88664 15.4372 6.80198 4.9876 5.9478 9.60662 numMergedOcc 0
45 mol 222 unq 15 iso 0 dist 7.11989 11.068 9.62632 5.78833 7.16819 12.9388 11.0888 7.97027 13.3586 6.23984 numMergedOcc 0
46 mol 222 unq 16 iso 0 dist 7.11989 11.068 9.62632 5.78833 7.16819 12.9388 5.93092 6.81955 5.16212 8.87178 numMergedOcc 0
47 mol 222 unq 17 iso 0 dist 7.11989 11.068 9.62632 5.78833 7.16819 12.9388 6.80198 4.9876 5.9478 7.13962 numMergedOcc 0
48 mol 222 unq 18 iso 0 dist 7.11989 12.6853 7.862 10.4275 9.08955 7.75466 11.0888 7.97027 8.84507 4.67663 numMergedOcc 0
49 mol 222 unq 19 iso 0 dist 7.11989 12.6853 7.862 10.4275 9.08955 7.75466 5.93092 6.81955 8.67203 9.32357 numMergedOcc 0
50 mol 222 unq 20 iso 0 dist 7.11989 12.6853 7.862 10.4275 9.08955 7.75466 6.80198 4.9876 6.02502 6.37382 numMergedOcc 0
51 mol 222 unq 21 iso 0 dist 7.11989 12.6853 7.862 9.86636 8.88664 12.1951 11.0888 7.97027 8.84507 4.00869 numMergedOcc 0
52 mol 222 unq 22 iso 0 dist 7.11989 12.6853 7.862 9.86636 8.88664 12.1951 5.93092 6.81955 8.67203 12.2233 numMergedOcc 0
53 mol 222 unq 23 iso 0 dist 7.11989 12.6853 7.862 9.86636 8.88664 12.1951 6.80198 4.9876 6.02502 9.60662 numMergedOcc 0
54 mol 222 unq 24 iso 0 dist 7.11989 12.6853 7.862 5.78833 7.16819 11.6161 11.0888 7.97027 8.84507 6.23984 numMergedOcc 0
55 mol 222 unq 25 iso 0 dist 7.11989 12.6853 7.862 5.78833 7.16819 11.6161 5.93092 6.81955 8.67203 8.87178 numMergedOcc 0
56 mol 222 unq 26 iso 0 dist 7.11989 12.6853 7.862 5.78833 7.16819 11.6161 6.80198 4.9876 6.02502 7.13962 numMergedOcc 0
57 mol 279 unq 0 iso 0 dist 7.84195 11.4893 8.29305 13.3542 9.30921 9.37316 5.03747 5.8304 6.5644 11.0079 numMergedOcc 0
58 mol 279 unq 1 iso 0 dist 7.84195 11.4893 8.29305 13.3542 9.30921 9.37316 14.9354 7.37478 8.70069 9.53157 numMergedOcc 0
59 mol 279 unq 2 iso 0 dist 7.84195 12.9462 6.43341 13.3542 9.30921 5.58929 5.03747 5.8304 9.40912 11.0079 numMergedOcc 0
60 mol 279 unq 3 iso 0 dist 7.84195 12.9462 6.43341 13.3542 9.30921 5.58929 14.9354 7.37478 4.14939 9.53157 numMergedOcc 0
61 mol 279 unq 4 iso 0 dist 9.2174 4.98462 8.29305 12.0995 9.30921 9.37316 9.59972 5.8304 6.5644 11.0079 numMergedOcc 0
62 mol 279 unq 5 iso 0 dist 9.2174 4.98462 8.29305 12.0995 9.30921 9.37316 6.63427 7.37478 8.70069 9.53157 numMergedOcc 0
63 mol 279 unq 6 iso 0 dist 9.2174 7.30763 6.43341 12.0995 9.30921 5.58929 9.59972 5.8304 9.40912 11.0079 numMergedOcc 0
64 mol 279 unq 7 iso 0 dist 9.2174 7.30763 6.43341 12.0995 9.30921 5.58929 6.63427 7.37478 4.14939 9.53157 numMergedOcc 0
