0 mol 24 unq 0 iso 0 dist 6.86014 7.33768 4.32034 5.69214 7.95042 10.8435 7.29868 8.52463 10.2653 5.80953 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.86014 9.01567 8.67951 5.69214 7.95042 10.8068 7.29868 8.52463 6.16544 5.80953 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.86116 8.44664 10.971 5.11636 7.95042 12.8213 8.60554 8.52463 14.1496 5.80953 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 8.86116 9.44691 13.4893 5.11636 7.95042 11.7489 8.60554 8.52463 9.62033 5.80953 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 5.54419 8.4051 5.11617 4.82629 6.6219 11.3231 11.3566 6.56748 9.92026 9.73647 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 5.54419 8.4051 5.11617 10.1698 5.68215 6.61696 11.3566 6.56748 9.92026 7.26334 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 5.54419 8.4051 5.11617 10.1698 5.68215 6.61696 9.83002 4.50066 6.16544 6.19899 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 5.54419 8.23446 13.1779 4.82629 6.6219 11.3777 11.3566 6.56748 19.302 9.73647 numMergedOcc 0
8 mol 24 unq 8 iso 0 dist 5.54419 8.23446 13.1779 10.1698 5.68215 16.1924 11.3566 6.56748 19.302 7.26334 numMergedOcc 0
9 mol 24 unq 9 iso 0 dist 5.54419 8.23446 13.1779 10.1698 5.68215 16.1924 9.83002 4.50066 17.5779 6.19899 numMergedOcc 0
10 mol 24 unq 10 iso 0 dist 5.54419 8.23446 13.1779 10.1698 5.68215 16.1924 8.4051 5.11617 14.1082 6.61696 numMergedOcc 0
11 mol 24 unq 11 iso 0 dist 5.54419 8.75662 10.8238 4.82629 6.6219 13.0711 11.3566 6.56748 16.397 9.73647 numMergedOcc 0
12 mol 24 unq 12 iso 0 dist 5.54419 8.75662 10.8238 10.1698 5.68215 15.3807 11.3566 6.56748 16.397 7.26334 numMergedOcc 0
13 mol 24 unq 13 iso 0 dist 5.54419 8.75662 10.8238 10.1698 5.68215 15.3807 9.83002 4.50066 13.1362 6.19899 numMergedOcc 0
14 mol 24 unq 14 iso 0 dist 5.54419 8.75662 10.8238 10.1698 5.68215 15.3807 8.4051 5.11617 9.62033 6.61696 numMergedOcc 0
15 mol 24 unq 15 iso 0 dist 7.36323 8.4051 13.2229 6.28159 8.87744 12.3034 8.23446 6.38336 14.1082 4.5711 numMergedOcc 0
16 mol 24 unq 16 iso 0 dist 7.36323 8.4051 13.2229 5.50396 7.27472 9.84204 8.23446 6.38336 14.1082 4.44526 numMergedOcc 0
17 mol 24 unq 17 iso 0 dist 7.36323 8.4051 13.2229 5.50396 7.27472 9.84204 8.75662 6.7828 9.62033 9.586 numMergedOcc 0
18 mol 24 unq 18 iso 0 dist 7.36323 8.23446 6.38336 5.50396 7.27472 4.44526 8.75662 6.7828 11.342 9.586 numMergedOcc 0
19 mol 24 unq 19 iso 0 dist 7.36323 8.75662 6.7828 6.28159 8.87744 12.6707 8.23446 6.38336 11.342 4.5711 numMergedOcc 0
20 mol 24 unq 20 iso 0 dist 7.36323 8.75662 6.7828 5.50396 7.27472 9.586 8.23446 6.38336 11.342 4.44526 numMergedOcc 0
21 mol 25 unq 0 iso 0 dist 5.04899 9.01548 13.9331 6.47509 7.05196 12.506 7.45383 7.33728 12.6805 5.20109 numMergedOcc 0
22 mol 25 unq 1 iso 0 dist 5.04899 8.87757 5.77929 13.6145 9.49421 6.53269 9.61019 6.68639 4.43692 9.81524 numMergedOcc 0
23 mol 25 unq 2 iso 0 dist 7.57578 8.50222 6.08585 5.18617 9.48085 6.53269 12.4659 9.15781 4.43692 9.81524 numMergedOcc 0
24 mol 25 unq 3 iso 0 dist 7.17969 7.55264 6.08585 5.68041 9.48085 6.53269 10.3593 9.15781 4.43692 9.81524 numMergedOcc 0
25 mol 58 unq 0 iso 0 dist 6.81627 7.21955 7.09066 5.61579 5.38524 10.4354 14.2075 9.37804 15.9732 9.02642 numMergedOcc 0
26 mol 58 unq 1 iso 0 dist 7.32874 7.21955 7.12541 5.61579 8.69057 10.4354 14.2075 14.0374 15.9732 9.02642 numMergedOcc 0
27 mol 92 unq 0 iso 0 dist 9.33898 8.91313 17.5889 4.3481 7.06939 12.7637 9.75237 9.44576 18.0963 6.87506 numMergedOcc 0
28 mol 92 unq 1 iso 0 dist 9.33898 8.16392 10.8304 4.3481 7.06939 11.1106 9.75237 9.44576 15.0895 6.87506 numMergedOcc 0
29 mol 92 unq 2 iso 0 dist 9.64443 8.91313 13.3881 5.31547 9.36001 12.273 9.75237 13.9524 18.0963 6.59716 numMergedOcc 0
30 mol 92 unq 3 iso 0 dist 9.64443 8.16392 5.90097 5.31547 9.36001 10.9647 9.75237 13.9524 15.0895 6.59716 numMergedOcc 0
31 mol 98 unq 0 iso 0 dist 5.08437 6.65501 4.4057 3.9764 5.10496 4.62494 11.3043 7.94178 10.2754 9.84703 numMergedOcc 0
32 mol 98 unq 1 iso 0 dist 6.48948 6.65501 7.42446 3.9764 5.92242 4.62494 11.3043 15.7178 10.2754 9.84703 numMergedOcc 0
33 mol 98 unq 2 iso 0 dist 6.10456 6.65501 9.67482 10.4782 7.54889 8.46823 11.3043 9.85543 10.2754 9.25444 numMergedOcc 0
34 mol 98 unq 3 iso 0 dist 6.10456 6.65501 9.67482 3.9764 5.2571 4.62494 11.3043 9.85543 10.2754 9.84703 numMergedOcc 0
35 mol 100 unq 0 iso 0 dist 9.60661 7.01812 5.80144 4.03277 8.91882 6.59691 9.1361 6.71012 4.36434 6.55173 numMergedOcc 0
36 mol 100 unq 1 iso 0 dist 6.65086 8.30845 5.80144 6.23008 8.91882 6.59691 9.5074 6.71012 4.36434 6.55173 numMergedOcc 0
37 mol 100 unq 2 iso 0 dist 6.65086 8.76378 12.3577 6.23008 8.91882 13.2391 9.5074 6.71012 16.5704 6.55173 numMergedOcc 0
38 mol 100 unq 3 iso 0 dist 6.65086 8.76378 12.3577 6.23008 8.91882 13.2391 8.30845 5.80144 13.3504 6.59691 numMergedOcc 0
39 mol 143 unq 0 iso 0 dist 5.99315 7.78652 6.48978 4.78563 5.37047 5.06564 8.91301 5.20762 4.30566 7.5373 numMergedOcc 0
40 mol 143 unq 1 iso 0 dist 5.99315 8.91301 5.20762 4.78563 5.37047 7.5373 7.78652 6.48978 4.30566 5.06564 numMergedOcc 0
41 mol 155 unq 0 iso 0 dist 6.43582 7.92304 5.50031 4.91785 8.97626 9.16358 10.3161 6.89781 6.56063 9.24038 numMergedOcc 0
42 mol 170 unq 0 iso 0 dist 9.76807 6.35982 4.34698 4.78249 9.51256 6.47164 7.51126 5.75144 6.24983 9.65126 numMergedOcc 0
43 mol 170 unq 1 iso 0 dist 9.76807 7.51126 5.75144 4.78249 9.51256 9.65126 6.35982 4.34698 6.24983 6.47164 numMergedOcc 0
44 mol 181 unq 0 iso 0 dist 9.1374 8.90963 8.91338 12.9532 9.76212 17.8171 12.4878 4.43096 13.214 7.35884 numMergedOcc 0
45 mol 181 unq 1 iso 0 dist 8.03334 6.59025 8.04639 6.50233 9.76212 11.6588 6.46704 4.43096 9.87773 7.35884 numMergedOcc 0
46 mol 181 unq 2 iso 0 dist 7.81386 9.39829 7.20191 6.8757 6.64173 12.6232 10.4943 5.63555 9.53592 8.12266 numMergedOcc 0
47 mol 181 unq 3 iso 0 dist 7.81386 9.39829 7.20191 5.83796 9.55105 8.4848 10.4943 5.63555 9.53592 9.43306 numMergedOcc 0
48 mol 181 unq 4 iso 0 dist 7.63312 5.9176 5.63555 5.93724 9.01624 10.5303 6.41453 7.20191 9.53592 5.99437 numMergedOcc 0
49 mol 181 unq 5 iso 0 dist 7.63312 5.9176 5.63555 5.12833 9.55105 9.43306 6.41453 7.20191 9.53592 8.4848 numMergedOcc 0
50 mol 181 unq 6 iso 0 dist 7.63312 6.41453 7.20191 10.6474 6.64173 12.6232 5.9176 5.63555 9.53592 8.12266 numMergedOcc 0
51 mol 181 unq 7 iso 0 dist 7.63312 6.41453 7.20191 5.12833 9.55105 8.4848 5.9176 5.63555 9.53592 9.43306 numMergedOcc 0
52 mol 222 unq 0 iso 0 dist 7.21333 9.82371 16.0949 6.84862 5.56538 14.0832 7.67576 7.75656 11.3283 8.43195 numMergedOcc 0
53 mol 222 unq 1 iso 0 dist 7.21333 9.82371 16.0949 9.53117 7.48954 14.9425 7.67576 7.75656 11.3283 8.23406 numMergedOcc 0
54 mol 224 unq 0 iso 0 dist 6.61986 9.51597 12.4692 5.13732 8.08349 10.7847 10.0553 10.7174 13.6892 5.05368 numMergedOcc 0
55 mol 227 unq 0 iso 0 dist 7.22101 7.43071 6.35849 5.0317 5.23634 9.18728 5.41321 10.9607 11.362 8.91971 numMergedOcc 0
56 mol 227 unq 1 iso 0 dist 7.22101 5.41321 10.9607 5.0317 5.23634 8.91971 7.43071 6.35849 11.362 9.18728 numMergedOcc 0
57 mol 227 unq 2 iso 0 dist 8.65997 7.43071 10.204 5.0317 6.91318 9.18728 5.41321 9.72615 11.362 8.91971 numMergedOcc 0
58 mol 227 unq 3 iso 0 dist 8.65997 5.41321 9.72615 5.0317 6.91318 8.91971 7.43071 10.204 11.362 9.18728 numMergedOcc 0
59 mol 227 unq 4 iso 0 dist 7.09863 6.02296 6.35849 5.83175 5.23634 9.18728 9.74265 10.9607 11.362 8.91971 numMergedOcc 0
60 mol 239 unq 0 iso 0 dist 6.16342 8.84636 4.30299 10.6736 6.73665 10.0627 11.308 11.169 15.2702 8.95511 numMergedOcc 0
61 mol 239 unq 1 iso 0 dist 6.16342 8.84636 4.30299 10.6736 6.73665 10.0627 10.3435 5.88931 7.06384 5.85002 numMergedOcc 0
