0 mol 24 unq 0 iso 0 dist 6.86014 9.41441 6.66749 7.95042 5.69214 10.0453 8.52463 7.29868 6.72323 5.80953 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.86116 9.41441 14.012 7.95042 5.11636 10.0453 8.52463 8.60554 6.72323 5.80953 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 5.54419 8.70827 5.59311 6.6219 4.82629 4.04519 6.56748 11.3566 11.9138 9.73647 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 5.54419 8.70827 5.59311 5.68215 10.1698 13.7009 6.56748 11.3566 11.9138 7.26334 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 5.54419 8.70827 5.59311 5.68215 10.1698 13.7009 4.50066 9.83002 11.8282 6.19899 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 5.54419 8.70827 5.59311 5.68215 10.1698 13.7009 5.11617 8.4051 12.8389 6.61696 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 5.54419 6.73939 12.176 6.6219 4.82629 12.5545 6.56748 11.3566 5.95834 9.73647 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 5.54419 6.73939 12.176 5.68215 10.1698 4.08755 6.56748 11.3566 5.95834 7.26334 numMergedOcc 0
8 mol 24 unq 8 iso 0 dist 5.54419 6.73939 12.176 5.68215 10.1698 4.08755 4.50066 9.83002 4.2121 6.19899 numMergedOcc 0
9 mol 24 unq 9 iso 0 dist 5.54419 6.73939 12.176 5.68215 10.1698 4.08755 5.11617 8.4051 6.72323 6.61696 numMergedOcc 0
10 mol 24 unq 10 iso 0 dist 7.36323 9.12854 5.59311 8.87744 6.28159 9.86385 6.38336 8.23446 11.4596 4.5711 numMergedOcc 0
11 mol 24 unq 11 iso 0 dist 7.36323 9.12854 5.59311 7.27472 5.50396 10.4353 6.38336 8.23446 11.4596 4.44526 numMergedOcc 0
12 mol 24 unq 12 iso 0 dist 7.36323 9.12854 5.59311 7.27472 5.50396 10.4353 6.7828 8.75662 11.6684 9.586 numMergedOcc 0
13 mol 25 unq 0 iso 0 dist 5.04899 7.45383 7.33728 6.55597 4.69295 4.98822 5.77929 8.87757 6.25843 9.16515 numMergedOcc 0
14 mol 25 unq 1 iso 0 dist 5.04899 7.45383 7.33728 7.07751 8.79309 7.91914 5.77929 8.87757 6.25843 9.82987 numMergedOcc 0
15 mol 25 unq 2 iso 0 dist 5.04899 7.45383 7.33728 9.49421 13.6145 9.62058 5.77929 8.87757 6.25843 6.53269 numMergedOcc 0
16 mol 25 unq 3 iso 0 dist 5.04899 7.45383 7.33728 9.49421 13.6145 9.62058 6.68639 9.61019 9.86839 9.81524 numMergedOcc 0
17 mol 25 unq 4 iso 0 dist 5.04899 9.01548 13.9331 6.55597 4.69295 13.4321 5.77929 8.87757 8.88938 9.16515 numMergedOcc 0
18 mol 25 unq 5 iso 0 dist 5.04899 9.01548 13.9331 7.07751 8.79309 9.66912 5.77929 8.87757 8.88938 9.82987 numMergedOcc 0
19 mol 25 unq 6 iso 0 dist 5.04899 9.01548 13.9331 9.49421 13.6145 5.38592 5.77929 8.87757 8.88938 6.53269 numMergedOcc 0
20 mol 25 unq 7 iso 0 dist 5.04899 9.01548 13.9331 9.49421 13.6145 5.38592 6.68639 9.61019 10.4292 9.81524 numMergedOcc 0
21 mol 25 unq 8 iso 0 dist 5.04899 8.87757 5.77929 7.05196 6.47509 3.904 7.33728 7.45383 6.25843 5.20109 numMergedOcc 0
22 mol 25 unq 9 iso 0 dist 7.57578 6.16347 9.34396 9.48085 5.18617 9.62058 6.08585 8.50222 6.25843 6.53269 numMergedOcc 0
23 mol 25 unq 10 iso 0 dist 7.57578 6.16347 9.34396 9.48085 5.18617 9.62058 9.15781 12.4659 9.86839 9.81524 numMergedOcc 0
24 mol 25 unq 11 iso 0 dist 7.57578 7.92503 6.11127 9.48085 5.18617 10.2758 6.08585 8.50222 11.4912 6.53269 numMergedOcc 0
25 mol 25 unq 12 iso 0 dist 7.57578 7.92503 6.11127 9.48085 5.18617 10.2758 9.15781 12.4659 14.4754 9.81524 numMergedOcc 0
26 mol 25 unq 13 iso 0 dist 7.17969 6.16347 10.8498 9.48085 5.68041 9.62058 6.08585 7.55264 6.25843 6.53269 numMergedOcc 0
27 mol 25 unq 14 iso 0 dist 7.17969 6.16347 10.8498 9.48085 5.68041 9.62058 9.15781 10.3593 9.86839 9.81524 numMergedOcc 0
28 mol 25 unq 15 iso 0 dist 7.17969 7.92503 5.30154 9.48085 5.68041 10.2758 6.08585 7.55264 11.4912 6.53269 numMergedOcc 0
29 mol 25 unq 16 iso 0 dist 7.17969 7.92503 5.30154 9.48085 5.68041 10.2758 9.15781 10.3593 14.4754 9.81524 numMergedOcc 0
30 mol 25 unq 17 iso 0 dist 7.31767 8.6653 5.64303 7.6114 6.10919 10.8122 5.68392 9.79094 12.0452 6.29797 numMergedOcc 0
31 mol 25 unq 18 iso 0 dist 6.03987 8.6653 5.82503 7.6114 5.86705 10.8122 5.68392 6.85556 12.0452 6.29797 numMergedOcc 0
32 mol 58 unq 0 iso 0 dist 6.62496 5.93884 5.78774 9.22598 9.87158 5.66912 9.95364 8.80614 10.2007 9.01564 numMergedOcc 0
33 mol 58 unq 1 iso 0 dist 6.35756 7.68678 5.78774 8.96727 9.87158 5.66912 5.49591 8.80614 10.2007 9.01564 numMergedOcc 0
34 mol 58 unq 2 iso 0 dist 6.35756 7.68678 5.78774 8.01308 5.86526 5.76523 5.49591 8.80614 10.2007 7.11065 numMergedOcc 0
35 mol 60 unq 0 iso 0 dist 8.7531 9.90939 7.04075 8.4312 8.62476 5.85676 5.94827 11.816 8.97364 6.63448 numMergedOcc 0
36 mol 98 unq 0 iso 0 dist 5.08437 6.7117 7.06961 5.10496 3.9764 3.94967 7.94178 11.3043 7.36769 9.84703 numMergedOcc 0
37 mol 98 unq 1 iso 0 dist 5.08437 6.7117 7.06961 5.10496 3.9764 3.94967 4.4057 6.65501 6.88901 4.62494 numMergedOcc 0
38 mol 98 unq 2 iso 0 dist 6.10456 4.47349 7.06961 7.54889 10.4782 3.92737 9.67482 6.65501 6.88901 8.46823 numMergedOcc 0
39 mol 98 unq 3 iso 0 dist 6.10456 4.47349 7.06961 7.54889 10.4782 3.92737 9.85543 11.3043 7.36769 9.25444 numMergedOcc 0
40 mol 98 unq 4 iso 0 dist 6.10456 4.47349 7.06961 5.2571 3.9764 3.94967 9.85543 11.3043 7.36769 9.84703 numMergedOcc 0
41 mol 98 unq 5 iso 0 dist 6.10456 4.47349 7.06961 5.2571 3.9764 3.94967 9.67482 6.65501 6.88901 4.62494 numMergedOcc 0
42 mol 100 unq 0 iso 0 dist 8.87449 7.80975 7.97897 9.90751 9.72773 15.0328 6.12107 12.0685 12.71 7.81446 numMergedOcc 0
43 mol 100 unq 1 iso 0 dist 8.87449 7.80975 7.97897 9.21662 9.39125 12.48 6.12107 12.0685 12.71 6.55173 numMergedOcc 0
44 mol 100 unq 2 iso 0 dist 8.87449 7.80975 7.97897 9.21662 9.39125 12.48 5.42531 10.9242 9.5057 6.59691 numMergedOcc 0
45 mol 119 unq 0 iso 0 dist 8.73993 6.52773 7.20179 7.64052 9.68677 5.37917 12.0175 17.8739 12.0976 8.67537 numMergedOcc 0
46 mol 119 unq 1 iso 0 dist 8.73993 9.23858 9.89358 7.64052 9.68677 15.7711 12.0175 17.8739 21.1416 8.67537 numMergedOcc 0
47 mol 119 unq 2 iso 0 dist 9.87172 9.11344 10.9441 6.99446 6.20019 5.37917 10.8661 11.5311 12.0976 8.67537 numMergedOcc 0
48 mol 119 unq 3 iso 0 dist 6.18601 8.00003 10.4376 8.95212 4.39676 12.3661 5.13589 6.73586 13.0074 8.67537 numMergedOcc 0
49 mol 167 unq 0 iso 0 dist 9.87651 9.67741 13.0123 7.02548 11.6011 5.95858 7.08726 16.4813 12.5323 8.86449 numMergedOcc 0
50 mol 181 unq 0 iso 0 dist 9.1374 6.2479 6.6251 9.76212 12.9532 6.39406 4.43096 12.4878 7.32087 7.35884 numMergedOcc 0
51 mol 181 unq 1 iso 0 dist 8.03334 6.2479 7.81713 9.76212 6.50233 6.39406 4.43096 6.46704 7.32087 7.35884 numMergedOcc 0
52 mol 181 unq 2 iso 0 dist 7.81386 5.94469 7.77758 6.64173 6.8757 4.98436 5.63555 10.4943 10.3104 8.12266 numMergedOcc 0
53 mol 181 unq 3 iso 0 dist 7.81386 5.94469 7.77758 9.01624 5.71898 11.9796 7.20191 9.39829 11.8933 5.99437 numMergedOcc 0
54 mol 181 unq 4 iso 0 dist 7.81386 5.94469 7.77758 9.55105 5.83796 12.3589 5.63555 10.4943 10.3104 9.43306 numMergedOcc 0
55 mol 181 unq 5 iso 0 dist 7.81386 5.94469 7.77758 9.55105 5.83796 12.3589 7.20191 9.39829 11.8933 8.4848 numMergedOcc 0
56 mol 181 unq 6 iso 0 dist 7.63312 5.94469 12.5387 6.64173 10.6474 4.98436 5.63555 5.9176 10.3104 8.12266 numMergedOcc 0
57 mol 181 unq 7 iso 0 dist 7.63312 5.94469 12.5387 9.01624 5.93724 11.9796 7.20191 6.41453 11.8933 5.99437 numMergedOcc 0
58 mol 181 unq 8 iso 0 dist 7.63312 5.94469 12.5387 9.55105 5.12833 12.3589 5.63555 5.9176 10.3104 9.43306 numMergedOcc 0
59 mol 181 unq 9 iso 0 dist 7.63312 5.94469 12.5387 9.55105 5.12833 12.3589 7.20191 6.41453 11.8933 8.4848 numMergedOcc 0
60 mol 204 unq 0 iso 0 dist 7.10633 9.68728 7.67571 7.9133 10.7169 14.0756 5.86489 11.5776 10.2072 9.48625 numMergedOcc 0
61 mol 204 unq 1 iso 0 dist 8.51516 9.68728 10.8573 7.9133 5.57347 14.0756 5.86489 7.32294 10.2072 9.48625 numMergedOcc 0
62 mol 232 unq 0 iso 0 dist 8.27212 9.05071 8.80479 6.71524 5.10213 11.2243 4.9377 9.40808 9.8664 9.9183 numMergedOcc 0
63 mol 273 unq 0 iso 0 dist 9.01049 8.49177 9.25493 9.59325 12.2939 3.78984 4.60101 11.6152 7.16346 6.35532 numMergedOcc 0
64 mol 292 unq 0 iso 0 dist 8.2734 7.07965 10.8848 7.20674 7.8414 13.8094 8.83082 14.0973 14.792 8.62162 numMergedOcc 0
