0 mol 24 unq 0 iso 0 dist 6.36381 5.80023 7.27472 4.36056 7.96195 10.0655 6.53276 4.44526 6.38336 9.22115 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.36381 5.80023 7.27472 4.36056 7.96195 10.0655 6.81998 9.586 6.7828 9.15493 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.90986 14.3129 9.12845 14.6525 6.38243 5.30734 14.288 6.81793 6.04762 5.66783 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.43496 9.56471 7.06939 12.2875 6.9223 6.08245 15.7834 6.87506 9.44576 8.67827 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 9.43496 9.56471 7.06939 4.98638 7.0561 6.86728 15.7834 6.87506 9.44576 13.0818 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.33961 11.1668 9.64383 3.92844 6.83746 8.76845 11.2155 9.25444 18.5442 14.6934 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.33961 11.1668 9.64383 3.92844 6.83746 8.76845 9.96465 8.46823 16.4267 11.4207 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 5.33961 11.1668 9.64383 8.99706 9.14707 11.7715 9.96465 8.46823 16.4267 8.26478 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 5.33961 11.1668 9.64383 8.99706 9.14707 11.7715 11.2155 9.25444 18.5442 16.2968 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 5.33961 12.7318 7.54889 3.92844 6.83746 13.9572 11.2155 9.25444 9.85543 14.6934 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 5.33961 12.7318 7.54889 3.92844 6.83746 13.9572 9.96465 8.46823 9.67482 11.4207 numMergedOcc 0
11 mol 98 unq 6 iso 0 dist 5.33961 12.7318 7.54889 8.99706 9.14707 13.1975 9.96465 8.46823 9.67482 8.26478 numMergedOcc 0
12 mol 98 unq 7 iso 0 dist 5.33961 12.7318 7.54889 8.99706 9.14707 13.1975 11.2155 9.25444 9.85543 16.2968 numMergedOcc 0
13 mol 98 unq 8 iso 0 dist 5.33961 12.3835 7.78931 3.92844 6.83746 14.5341 11.2155 9.25444 7.28361 14.6934 numMergedOcc 0
14 mol 98 unq 9 iso 0 dist 5.33961 12.3835 7.78931 3.92844 6.83746 14.5341 9.96465 8.46823 12.0974 11.4207 numMergedOcc 0
15 mol 98 unq 10 iso 0 dist 5.33961 12.3835 7.78931 8.99706 9.14707 15.9953 9.96465 8.46823 12.0974 8.26478 numMergedOcc 0
16 mol 98 unq 11 iso 0 dist 5.33961 12.3835 7.78931 8.99706 9.14707 15.9953 11.2155 9.25444 7.28361 16.2968 numMergedOcc 0
17 mol 98 unq 12 iso 0 dist 8.3505 4.75138 5.10496 8.89866 8.75597 7.32662 11.9783 9.84703 7.94178 8.02554 numMergedOcc 0
18 mol 98 unq 13 iso 0 dist 8.3505 4.75138 5.10496 8.89866 8.75597 7.32662 7.43001 4.62494 4.4057 11.2092 numMergedOcc 0
19 mol 98 unq 14 iso 0 dist 8.3505 4.75138 5.10496 15.0551 9.18457 12.3881 11.9783 9.84703 7.94178 16.2968 numMergedOcc 0
20 mol 98 unq 15 iso 0 dist 8.3505 4.75138 5.10496 15.0551 9.18457 12.3881 7.43001 4.62494 4.4057 8.26478 numMergedOcc 0
21 mol 98 unq 16 iso 0 dist 8.3505 10.4417 5.92242 8.89866 8.75597 13.4985 11.9783 9.84703 15.7178 8.02554 numMergedOcc 0
22 mol 98 unq 17 iso 0 dist 8.3505 10.4417 5.92242 8.89866 8.75597 13.4985 7.43001 4.62494 7.42446 11.2092 numMergedOcc 0
23 mol 98 unq 18 iso 0 dist 8.3505 10.4417 5.92242 15.0551 9.18457 7.89505 11.9783 9.84703 15.7178 16.2968 numMergedOcc 0
24 mol 98 unq 19 iso 0 dist 8.3505 10.4417 5.92242 15.0551 9.18457 7.89505 7.43001 4.62494 7.42446 8.26478 numMergedOcc 0
25 mol 98 unq 20 iso 0 dist 8.3505 11.3628 5.2571 8.89866 8.75597 6.934 11.9783 9.84703 9.85543 8.02554 numMergedOcc 0
26 mol 98 unq 21 iso 0 dist 8.3505 11.3628 5.2571 8.89866 8.75597 6.934 7.43001 4.62494 9.67482 11.2092 numMergedOcc 0
27 mol 98 unq 22 iso 0 dist 8.3505 11.3628 5.2571 15.0551 9.18457 13.1975 11.9783 9.84703 9.85543 16.2968 numMergedOcc 0
28 mol 98 unq 23 iso 0 dist 8.3505 11.3628 5.2571 15.0551 9.18457 13.1975 7.43001 4.62494 9.67482 8.26478 numMergedOcc 0
29 mol 98 unq 24 iso 0 dist 8.3505 13.9599 8.7497 8.89866 8.75597 7.17433 11.9783 9.84703 7.28361 8.02554 numMergedOcc 0
30 mol 98 unq 25 iso 0 dist 8.3505 13.9599 8.7497 8.89866 8.75597 7.17433 7.43001 4.62494 12.0974 11.2092 numMergedOcc 0
31 mol 98 unq 26 iso 0 dist 8.3505 13.9599 8.7497 15.0551 9.18457 15.9953 11.9783 9.84703 7.28361 16.2968 numMergedOcc 0
32 mol 98 unq 27 iso 0 dist 8.3505 13.9599 8.7497 15.0551 9.18457 15.9953 7.43001 4.62494 12.0974 8.26478 numMergedOcc 0
33 mol 98 unq 28 iso 0 dist 9.29816 5.70962 9.64383 5.29931 6.83746 8.76845 18.3829 9.25444 18.5442 14.6934 numMergedOcc 0
34 mol 98 unq 29 iso 0 dist 9.29816 5.70962 9.64383 5.29931 6.83746 8.76845 13.7832 8.46823 16.4267 11.4207 numMergedOcc 0
35 mol 98 unq 30 iso 0 dist 9.29816 5.70962 9.64383 7.18776 9.14707 11.7715 13.7832 8.46823 16.4267 8.26478 numMergedOcc 0
36 mol 98 unq 31 iso 0 dist 9.29816 5.70962 9.64383 7.18776 9.14707 11.7715 18.3829 9.25444 18.5442 16.2968 numMergedOcc 0
37 mol 98 unq 32 iso 0 dist 9.29816 14.676 7.54889 5.29931 6.83746 13.9572 18.3829 9.25444 9.85543 14.6934 numMergedOcc 0
38 mol 98 unq 33 iso 0 dist 9.29816 14.676 7.54889 5.29931 6.83746 13.9572 13.7832 8.46823 9.67482 11.4207 numMergedOcc 0
39 mol 98 unq 34 iso 0 dist 9.29816 14.676 7.54889 7.18776 9.14707 13.1975 13.7832 8.46823 9.67482 8.26478 numMergedOcc 0
40 mol 98 unq 35 iso 0 dist 9.29816 14.676 7.54889 7.18776 9.14707 13.1975 18.3829 9.25444 9.85543 16.2968 numMergedOcc 0
41 mol 98 unq 36 iso 0 dist 9.29816 16.3389 7.78931 5.29931 6.83746 14.5341 18.3829 9.25444 7.28361 14.6934 numMergedOcc 0
42 mol 98 unq 37 iso 0 dist 9.29816 16.3389 7.78931 5.29931 6.83746 14.5341 13.7832 8.46823 12.0974 11.4207 numMergedOcc 0
43 mol 98 unq 38 iso 0 dist 9.29816 16.3389 7.78931 7.18776 9.14707 15.9953 13.7832 8.46823 12.0974 8.26478 numMergedOcc 0
44 mol 98 unq 39 iso 0 dist 9.29816 16.3389 7.78931 7.18776 9.14707 15.9953 18.3829 9.25444 7.28361 16.2968 numMergedOcc 0
45 mol 98 unq 40 iso 0 dist 5.08983 10.1978 9.64383 10.8121 6.83746 8.76845 9.51607 9.25444 18.5442 14.6934 numMergedOcc 0
46 mol 98 unq 41 iso 0 dist 5.08983 10.1978 9.64383 10.8121 6.83746 8.76845 12.5752 8.46823 16.4267 11.4207 numMergedOcc 0
47 mol 98 unq 42 iso 0 dist 5.08983 10.1978 9.64383 13.8773 9.14707 11.7715 12.5752 8.46823 16.4267 8.26478 numMergedOcc 0
48 mol 98 unq 43 iso 0 dist 5.08983 10.1978 9.64383 13.8773 9.14707 11.7715 9.51607 9.25444 18.5442 16.2968 numMergedOcc 0
49 mol 98 unq 44 iso 0 dist 5.08983 7.1452 7.54889 10.8121 6.83746 13.9572 9.51607 9.25444 9.85543 14.6934 numMergedOcc 0
50 mol 98 unq 45 iso 0 dist 5.08983 7.1452 7.54889 10.8121 6.83746 13.9572 12.5752 8.46823 9.67482 11.4207 numMergedOcc 0
51 mol 98 unq 46 iso 0 dist 5.08983 7.1452 7.54889 13.8773 9.14707 13.1975 12.5752 8.46823 9.67482 8.26478 numMergedOcc 0
52 mol 98 unq 47 iso 0 dist 5.08983 7.1452 7.54889 13.8773 9.14707 13.1975 9.51607 9.25444 9.85543 16.2968 numMergedOcc 0
53 mol 98 unq 48 iso 0 dist 5.08983 4.96747 7.78931 10.8121 6.83746 14.5341 9.51607 9.25444 7.28361 14.6934 numMergedOcc 0
54 mol 98 unq 49 iso 0 dist 5.08983 4.96747 7.78931 10.8121 6.83746 14.5341 12.5752 8.46823 12.0974 11.4207 numMergedOcc 0
55 mol 98 unq 50 iso 0 dist 5.08983 4.96747 7.78931 13.8773 9.14707 15.9953 12.5752 8.46823 12.0974 8.26478 numMergedOcc 0
56 mol 98 unq 51 iso 0 dist 5.08983 4.96747 7.78931 13.8773 9.14707 15.9953 9.51607 9.25444 7.28361 16.2968 numMergedOcc 0
57 mol 154 unq 0 iso 0 dist 5.06116 5.5065 8.33439 7.86748 9.82982 6.55507 9.10645 8.71789 7.51976 13.1849 numMergedOcc 0
58 mol 154 unq 1 iso 0 dist 5.06116 5.5065 8.33439 7.86748 9.82982 6.55507 4.02111 5.2693 7.23684 11.4511 numMergedOcc 0
59 mol 186 unq 0 iso 0 dist 6.52441 11.7795 7.2793 9.07895 8.31881 6.87725 6.33168 6.88127 10.5063 6.16503 numMergedOcc 0
60 mol 188 unq 0 iso 0 dist 7.6482 6.04074 7.88013 6.40978 7.79115 5.48276 5.15888 8.66624 8.77113 5.0782 numMergedOcc 0
61 mol 239 unq 0 iso 0 dist 7.63381 9.86326 6.73665 9.43815 8.88763 13.1624 15.9388 8.95511 11.169 16.7674 numMergedOcc 0
62 mol 239 unq 1 iso 0 dist 7.63381 9.86326 6.73665 9.43815 8.88763 13.1624 4.22981 5.85002 5.88931 9.48848 numMergedOcc 0
63 mol 239 unq 2 iso 0 dist 7.63381 9.86326 6.73665 9.79222 6.43209 7.34872 15.9388 8.95511 11.169 13.3917 numMergedOcc 0
64 mol 239 unq 3 iso 0 dist 7.63381 9.86326 6.73665 9.79222 6.43209 7.34872 4.22981 5.85002 5.88931 6.77384 numMergedOcc 0
65 mol 239 unq 4 iso 0 dist 7.63381 9.86326 6.73665 15.2256 8.48769 8.9361 15.9388 8.95511 11.169 9.38172 numMergedOcc 0
66 mol 239 unq 5 iso 0 dist 7.63381 9.86326 6.73665 15.2256 8.48769 8.9361 4.22981 5.85002 5.88931 11.9537 numMergedOcc 0
67 mol 239 unq 6 iso 0 dist 7.63381 5.82779 9.34438 9.43815 8.88763 5.75834 15.9388 8.95511 18.2672 16.7674 numMergedOcc 0
68 mol 239 unq 7 iso 0 dist 7.63381 5.82779 9.34438 9.43815 8.88763 5.75834 4.22981 5.85002 6.22471 9.48848 numMergedOcc 0
69 mol 239 unq 8 iso 0 dist 7.63381 5.82779 9.34438 9.79222 6.43209 7.5231 15.9388 8.95511 18.2672 13.3917 numMergedOcc 0
70 mol 239 unq 9 iso 0 dist 7.63381 5.82779 9.34438 9.79222 6.43209 7.5231 4.22981 5.85002 6.22471 6.77384 numMergedOcc 0
71 mol 239 unq 10 iso 0 dist 7.63381 5.82779 9.34438 15.2256 8.48769 14.4518 15.9388 8.95511 18.2672 9.38172 numMergedOcc 0
72 mol 239 unq 11 iso 0 dist 7.63381 5.82779 9.34438 15.2256 8.48769 14.4518 4.22981 5.85002 6.22471 11.9537 numMergedOcc 0
73 mol 239 unq 12 iso 0 dist 7.63381 13.5224 9.35949 9.43815 8.88763 10.7034 15.9388 8.95511 13.9678 16.7674 numMergedOcc 0
74 mol 239 unq 13 iso 0 dist 7.63381 13.5224 9.35949 9.43815 8.88763 10.7034 4.22981 5.85002 9.88845 9.48848 numMergedOcc 0
75 mol 239 unq 14 iso 0 dist 7.63381 13.5224 9.35949 9.79222 6.43209 4.15997 15.9388 8.95511 13.9678 13.3917 numMergedOcc 0
76 mol 239 unq 15 iso 0 dist 7.63381 13.5224 9.35949 9.79222 6.43209 4.15997 4.22981 5.85002 9.88845 6.77384 numMergedOcc 0
77 mol 239 unq 16 iso 0 dist 7.63381 13.5224 9.35949 15.2256 8.48769 5.66218 15.9388 8.95511 13.9678 9.38172 numMergedOcc 0
78 mol 239 unq 17 iso 0 dist 7.63381 13.5224 9.35949 15.2256 8.48769 5.66218 4.22981 5.85002 9.88845 11.9537 numMergedOcc 0
79 mol 273 unq 0 iso 0 dist 8.89714 8.50795 6.31969 5.62645 5.4307 5.9476 13.9497 5.61969 7.81483 9.76492 numMergedOcc 0
80 mol 273 unq 1 iso 0 dist 8.89714 8.50795 6.31969 5.62645 5.4307 5.9476 15.8207 9.0277 7.92179 11.5256 numMergedOcc 0
81 mol 279 unq 0 iso 0 dist 7.59142 11.6042 6.35028 6.06247 5.81528 6.15987 4.01471 7.17958 12.6502 8.43508 numMergedOcc 0
