0 mol 7 unq 0 iso 0 dist 8.41585 5.99459 6.88805 12.2041 10.5461 9.67164 6.06176 6.36911 8.81608 10.515 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 9.67164 13.156 12.2041 12.2333 5.99459 10.515 9.36807 8.81608 6.06176 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 5.04899 9.49421 13.6145 10.9391 11.9561 9.48085 4.70708 9.43699 8.53931 12.1492 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 7.57578 9.48085 5.18617 10.9391 12.7009 9.49421 12.1492 12.8446 8.53931 4.70708 numMergedOcc 0
4 mol 25 unq 2 iso 0 dist 7.17969 9.48085 5.68041 10.9391 12.8117 9.49421 12.1492 11.7303 8.53931 4.70708 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 6.81627 5.38524 5.61579 5.79773 11.715 8.66539 5.98837 8.26899 7.03126 10.8078 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 6.81627 5.38524 5.61579 5.79773 11.715 8.66539 8.48255 10.947 9.68228 6.35371 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 6.81627 5.38524 5.61579 5.47421 7.32874 8.69057 5.98837 8.26899 7.03126 4.55117 numMergedOcc 0
8 mol 58 unq 3 iso 0 dist 6.81627 5.38524 5.61579 5.47421 7.32874 8.69057 8.48255 10.947 9.68228 13.3401 numMergedOcc 0
9 mol 58 unq 4 iso 0 dist 7.32874 8.69057 5.61579 10.8779 11.715 8.66539 4.55117 8.26899 7.03126 10.8078 numMergedOcc 0
10 mol 58 unq 5 iso 0 dist 7.32874 8.69057 5.61579 10.8779 11.715 8.66539 13.3401 10.947 9.68228 6.35371 numMergedOcc 0
11 mol 58 unq 6 iso 0 dist 7.32874 8.69057 5.61579 5.47421 6.81627 5.38524 4.55117 8.26899 7.03126 5.98837 numMergedOcc 0
12 mol 58 unq 7 iso 0 dist 7.32874 8.69057 5.61579 5.47421 6.81627 5.38524 13.3401 10.947 9.68228 8.48255 numMergedOcc 0
13 mol 58 unq 8 iso 0 dist 6.64012 9.08221 4.00553 7.5247 10.3988 9.97769 11.6697 10.5905 8.13051 10.3598 numMergedOcc 0
14 mol 58 unq 9 iso 0 dist 6.64012 9.08221 4.00553 10.0658 11.221 9.32706 11.6697 10.5905 8.13051 6.00578 numMergedOcc 0
15 mol 58 unq 10 iso 0 dist 9.4099 9.08221 8.55984 7.5247 11.9025 9.97769 11.6697 15.9825 8.13051 10.3598 numMergedOcc 0
16 mol 58 unq 11 iso 0 dist 9.4099 9.08221 8.55984 10.0658 14.7109 9.32706 11.6697 15.9825 8.13051 6.00578 numMergedOcc 0
17 mol 72 unq 0 iso 0 dist 8.8178 7.12321 4.27726 5.36766 12.8385 9.74228 9.0131 13.3133 9.14817 6.00418 numMergedOcc 0
18 mol 72 unq 1 iso 0 dist 8.8178 7.12321 4.27726 8.24309 9.84449 6.21799 9.0131 13.3133 9.14817 6.11922 numMergedOcc 0
19 mol 72 unq 2 iso 0 dist 9.96708 7.12321 7.47371 5.36766 10.8086 9.74228 9.0131 7.321 9.14817 6.00418 numMergedOcc 0
20 mol 72 unq 3 iso 0 dist 9.96708 7.12321 7.47371 8.24309 9.78528 6.21799 9.0131 7.321 9.14817 6.11922 numMergedOcc 0
21 mol 72 unq 4 iso 0 dist 9.78528 6.21799 7.47371 7.04035 10.8086 9.74228 6.11922 7.321 9.14817 6.00418 numMergedOcc 0
22 mol 72 unq 5 iso 0 dist 9.78528 6.21799 7.47371 8.24309 9.96708 7.12321 6.11922 7.321 9.14817 9.0131 numMergedOcc 0
23 mol 72 unq 6 iso 0 dist 9.78528 5.03251 9.67587 5.8486 15.1902 9.56773 6.11922 7.321 9.76686 9.93049 numMergedOcc 0
24 mol 98 unq 0 iso 0 dist 5.08437 5.10496 3.9764 9.51923 6.48948 5.92242 8.70415 10.417 6.61111 9.74284 numMergedOcc 0
25 mol 98 unq 1 iso 0 dist 5.08437 5.10496 3.9764 8.40073 6.10456 5.2571 8.70415 10.417 6.61111 10.0962 numMergedOcc 0
26 mol 98 unq 2 iso 0 dist 5.08437 5.10496 3.9764 10.2427 10.1136 8.7497 8.70415 10.417 6.61111 11.2452 numMergedOcc 0
27 mol 98 unq 3 iso 0 dist 6.48948 5.92242 3.9764 9.51923 5.08437 5.10496 9.74284 10.417 6.61111 8.70415 numMergedOcc 0
28 mol 98 unq 4 iso 0 dist 6.48948 5.92242 3.9764 9.42358 6.10456 5.2571 9.74284 10.417 6.61111 10.0962 numMergedOcc 0
29 mol 98 unq 5 iso 0 dist 6.48948 5.92242 3.9764 13.9786 10.1136 8.7497 9.74284 10.417 6.61111 11.2452 numMergedOcc 0
30 mol 98 unq 6 iso 0 dist 6.10456 7.54889 10.4782 13.659 17.4071 9.64383 10.0962 10.417 4.44979 12.0058 numMergedOcc 0
31 mol 98 unq 7 iso 0 dist 6.10456 7.54889 10.4782 5.02887 10.1136 7.78931 10.0962 10.417 4.44979 11.2452 numMergedOcc 0
32 mol 98 unq 8 iso 0 dist 6.10456 5.2571 3.9764 8.40073 5.08437 5.10496 10.0962 10.417 6.61111 8.70415 numMergedOcc 0
33 mol 98 unq 9 iso 0 dist 6.10456 5.2571 3.9764 9.42358 6.48948 5.92242 10.0962 10.417 6.61111 9.74284 numMergedOcc 0
34 mol 98 unq 10 iso 0 dist 6.10456 5.2571 3.9764 5.02887 10.1136 8.7497 10.0962 10.417 6.61111 11.2452 numMergedOcc 0
35 mol 115 unq 0 iso 0 dist 7.30858 9.42082 15.3161 7.69052 13.8473 6.39384 10.9739 17.6696 8.0168 10.7942 numMergedOcc 0
36 mol 115 unq 1 iso 0 dist 9.33865 6.39384 6.63111 7.69052 5.83991 9.42082 10.7942 7.76729 8.0168 10.9739 numMergedOcc 0
37 mol 115 unq 2 iso 0 dist 5.83991 9.42082 6.63111 7.69052 9.33865 6.39384 10.9739 7.76729 8.0168 10.7942 numMergedOcc 0
38 mol 115 unq 3 iso 0 dist 6.11741 6.39384 6.07067 7.69052 7.88312 9.42082 10.7942 12.9821 8.0168 10.9739 numMergedOcc 0
39 mol 115 unq 4 iso 0 dist 7.88312 9.42082 6.07067 7.69052 6.11741 6.39384 10.9739 12.9821 8.0168 10.7942 numMergedOcc 0
40 mol 119 unq 0 iso 0 dist 8.73993 7.64052 9.68677 9.93257 16.4353 8.95212 10.0197 14.0269 6.13374 10.3457 numMergedOcc 0
41 mol 119 unq 1 iso 0 dist 8.73993 7.64052 9.68677 9.93257 16.4353 8.95212 10.6679 9.63176 9.08536 16.7975 numMergedOcc 0
42 mol 119 unq 2 iso 0 dist 8.73993 7.64052 9.68677 4.85907 10.3704 6.99446 10.0197 14.0269 6.13374 6.35763 numMergedOcc 0
43 mol 119 unq 3 iso 0 dist 8.73993 7.64052 9.68677 4.85907 10.3704 6.99446 10.6679 9.63176 9.08536 7.36192 numMergedOcc 0
44 mol 119 unq 4 iso 0 dist 9.87172 6.99446 6.20019 10.9871 13.9919 8.95212 6.35763 6.19042 6.13374 10.3457 numMergedOcc 0
45 mol 119 unq 5 iso 0 dist 9.87172 6.99446 6.20019 10.9871 13.9919 8.95212 7.36192 7.44174 9.08536 16.7975 numMergedOcc 0
46 mol 119 unq 6 iso 0 dist 9.87172 6.99446 6.20019 4.85907 12.6489 7.64052 6.35763 6.19042 6.13374 10.0197 numMergedOcc 0
47 mol 119 unq 7 iso 0 dist 9.87172 6.99446 6.20019 4.85907 12.6489 7.64052 7.36192 7.44174 9.08536 10.6679 numMergedOcc 0
48 mol 119 unq 8 iso 0 dist 6.18601 8.95212 4.39676 10.9871 10.1813 6.99446 10.3457 8.43904 6.13374 6.35763 numMergedOcc 0
49 mol 119 unq 9 iso 0 dist 6.18601 8.95212 4.39676 10.9871 10.1813 6.99446 16.7975 13.4411 9.08536 7.36192 numMergedOcc 0
50 mol 119 unq 10 iso 0 dist 6.18601 8.95212 4.39676 9.93257 9.72413 7.64052 10.3457 8.43904 6.13374 10.0197 numMergedOcc 0
51 mol 119 unq 11 iso 0 dist 6.18601 8.95212 4.39676 9.93257 9.72413 7.64052 16.7975 13.4411 9.08536 10.6679 numMergedOcc 0
52 mol 134 unq 0 iso 0 dist 8.94367 9.33094 7.41373 6.81259 9.86662 8.69531 5.3585 11.2292 7.43401 6.74887 numMergedOcc 0
53 mol 134 unq 1 iso 0 dist 6.37586 9.33094 10.8635 6.81259 9.71307 8.69531 5.3585 10.9613 7.43401 6.74887 numMergedOcc 0
54 mol 134 unq 2 iso 0 dist 6.49416 9.33094 12.3479 6.81259 12.5075 8.69531 5.3585 10.9685 7.43401 6.74887 numMergedOcc 0
55 mol 134 unq 3 iso 0 dist 9.86662 9.1998 12.8086 11.6064 15.281 6.42772 6.74887 11.2292 6.44575 5.31077 numMergedOcc 0
56 mol 134 unq 4 iso 0 dist 9.86662 9.1998 12.8086 7.09823 14.0375 8.70621 6.74887 11.2292 6.44575 10.9715 numMergedOcc 0
57 mol 134 unq 5 iso 0 dist 9.86662 8.69531 7.41373 6.81259 8.94367 9.33094 6.74887 11.2292 7.43401 5.3585 numMergedOcc 0
58 mol 134 unq 6 iso 0 dist 9.71307 9.1998 15.0225 11.6064 15.6507 6.42772 6.74887 10.9613 6.44575 5.31077 numMergedOcc 0
59 mol 134 unq 7 iso 0 dist 9.71307 9.1998 15.0225 7.09823 15.9508 8.70621 6.74887 10.9613 6.44575 10.9715 numMergedOcc 0
60 mol 134 unq 8 iso 0 dist 9.71307 8.69531 10.8635 6.81259 6.37586 9.33094 6.74887 10.9613 7.43401 5.3585 numMergedOcc 0
61 mol 167 unq 0 iso 0 dist 9.87651 7.02548 11.6011 4.70068 12.4733 6.84752 6.36909 15.1367 7.30954 7.69326 numMergedOcc 0
62 mol 167 unq 1 iso 0 dist 9.87651 7.02548 11.6011 10.3445 17.5366 7.86563 6.36909 15.1367 7.30954 9.46955 numMergedOcc 0
63 mol 181 unq 0 iso 0 dist 7.81386 9.01624 5.71898 11.5866 9.81747 5.05973 6.7991 4.93785 6.76746 8.35755 numMergedOcc 0
64 mol 181 unq 1 iso 0 dist 7.63312 9.01624 5.93724 11.5866 9.11469 5.05973 6.7991 10.1232 6.76746 8.35755 numMergedOcc 0
65 mol 224 unq 0 iso 0 dist 6.61986 8.08349 5.13732 10.3613 13.4025 9.78218 10.7113 8.19953 5.73591 11.4252 numMergedOcc 0
66 mol 224 unq 1 iso 0 dist 6.61986 8.08349 5.13732 10.3613 13.4025 9.78218 11.4491 11.5717 8.55345 9.14568 numMergedOcc 0
67 mol 234 unq 0 iso 0 dist 9.45496 7.81215 12.4252 10.2693 17.458 5.64285 5.56749 15.004 9.11572 8.0608 numMergedOcc 0
68 mol 234 unq 1 iso 0 dist 9.45496 7.81215 12.4252 10.2693 17.458 5.64285 15.015 21.615 9.49229 5.34613 numMergedOcc 0
69 mol 234 unq 2 iso 0 dist 9.45496 7.81215 12.4252 10.2693 17.458 5.64285 12.1076 17.6567 7.20293 6.29366 numMergedOcc 0
70 mol 234 unq 3 iso 0 dist 6.7625 7.81215 5.75498 10.2693 10.701 5.64285 5.56749 10.8628 9.11572 8.0608 numMergedOcc 0
71 mol 234 unq 4 iso 0 dist 6.7625 7.81215 5.75498 10.2693 10.701 5.64285 15.015 15.1691 9.49229 5.34613 numMergedOcc 0
72 mol 234 unq 5 iso 0 dist 6.7625 7.81215 5.75498 10.2693 10.701 5.64285 12.1076 12.6312 7.20293 6.29366 numMergedOcc 0
73 mol 238 unq 0 iso 0 dist 5.72887 9.72188 7.06793 15.7907 14.6111 9.12776 15.5674 15.9735 9.84652 8.82861 numMergedOcc 0
74 mol 238 unq 1 iso 0 dist 6.22714 9.08509 12.7938 10.1813 11.0896 6.99888 5.17471 7.49471 5.43613 5.54325 numMergedOcc 0
75 mol 238 unq 2 iso 0 dist 6.22714 9.08509 12.7938 10.1813 11.0896 6.99888 5.03393 10.9946 7.06768 10.0613 numMergedOcc 0
76 mol 238 unq 3 iso 0 dist 7.31233 9.12776 10.3162 15.7907 19.5656 9.72188 8.82861 9.38422 9.84652 15.5674 numMergedOcc 0
77 mol 238 unq 4 iso 0 dist 7.31233 9.08509 11.0772 10.1813 11.5794 6.99888 5.17471 7.19008 5.43613 5.54325 numMergedOcc 0
78 mol 238 unq 5 iso 0 dist 7.31233 9.08509 11.0772 10.1813 11.5794 6.99888 5.03393 11.3465 7.06768 10.0613 numMergedOcc 0
79 mol 259 unq 0 iso 0 dist 7.46176 5.85442 10.067 9.98105 12.0576 6.9899 5.79468 7.48005 6.23661 5.31048 numMergedOcc 0
80 mol 259 unq 1 iso 0 dist 5.30224 6.9899 7.09907 9.98105 11.858 5.85442 5.31048 8.37865 6.23661 5.79468 numMergedOcc 0
