0 mol 19 unq 0 iso 0 dist 8.4674 4.54938 7.67038 7.82074 10.3915 5.03957 6.41575 4.64838 4.97119 6.01808 5.80928 4.51865 6.864 11.0366 6.41423 numMergedOcc 0
1 mol 19 unq 0 iso 1 dist 8.4674 7.82074 10.3915 4.54938 7.67038 5.03957 6.41575 4.64838 6.01808 4.97119 5.80928 4.51865 11.0366 6.864 6.41423 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 7.75618 9.74255 4.96411 7.08342 7.67038 8.4674 10.4091 4.51865 8.40416 numMergedOcc 0
3 mol 19 unq 1 iso 1 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 7.75618 9.74255 7.08342 4.96411 7.67038 8.4674 4.51865 10.4091 8.40416 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 7.75618 9.74255 4.96411 7.08342 5.03957 7.82074 12.1187 11.0366 12.3215 numMergedOcc 0
5 mol 19 unq 2 iso 1 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 7.75618 9.74255 7.08342 4.96411 5.03957 7.82074 11.0366 12.1187 12.3215 numMergedOcc 0
6 mol 19 unq 3 iso 0 dist 4.54938 8.4674 7.67038 7.82074 5.03957 10.3915 6.41575 4.97119 4.64838 6.01808 7.34551 7.20519 10.4091 12.1187 10.741 numMergedOcc 0
7 mol 19 unq 3 iso 1 dist 4.54938 7.82074 5.03957 8.4674 7.67038 10.3915 6.41575 4.97119 6.01808 4.64838 7.34551 7.20519 12.1187 10.4091 10.741 numMergedOcc 0
8 mol 19 unq 4 iso 0 dist 4.54938 8.4674 7.67038 7.82074 5.03957 10.3915 6.41575 4.97119 4.64838 6.01808 5.80928 6.864 4.51865 11.0366 6.41423 numMergedOcc 0
9 mol 19 unq 4 iso 1 dist 4.54938 7.82074 5.03957 8.4674 7.67038 10.3915 6.41575 4.97119 6.01808 4.64838 5.80928 6.864 11.0366 4.51865 6.41423 numMergedOcc 0
10 mol 19 unq 5 iso 0 dist 6.864 7.20519 7.07775 4.54938 5.80928 7.34551 7.75618 7.08342 4.96411 9.74255 7.67038 4.51865 10.4091 8.4674 8.40416 numMergedOcc 0
11 mol 19 unq 5 iso 1 dist 6.864 4.54938 5.80928 7.20519 7.07775 7.34551 7.75618 7.08342 9.74255 4.96411 7.67038 4.51865 8.4674 10.4091 8.40416 numMergedOcc 0
12 mol 58 unq 0 iso 0 dist 9.55426 6.81627 9.7274 7.32874 5.90225 5.47421 7.21955 5.74871 7.09066 7.12541 10.6169 9.4099 15.2973 11.396 12.3035 numMergedOcc 0
13 mol 58 unq 0 iso 1 dist 9.55426 7.32874 5.90225 6.81627 9.7274 5.47421 7.21955 5.74871 7.12541 7.09066 10.6169 9.4099 11.396 15.2973 12.3035 numMergedOcc 0
14 mol 59 unq 0 iso 0 dist 7.71095 8.84665 12.5396 8.25513 8.19458 6.40295 6.73347 9.64444 4.36133 6.66692 10.0246 6.85766 17.79 14.0127 14.8852 numMergedOcc 0
15 mol 59 unq 0 iso 1 dist 7.71095 8.25513 8.19458 8.84665 12.5396 6.40295 6.73347 9.64444 6.66692 4.36133 10.0246 6.85766 14.0127 17.79 14.8852 numMergedOcc 0
16 mol 73 unq 0 iso 0 dist 9.96396 6.19304 5.4148 8.70481 14.9342 13.3558 9.24757 5.11416 6.56633 15.3808 15.7123 9.38498 10.2049 20.257 13.8696 numMergedOcc 0
17 mol 73 unq 0 iso 1 dist 9.96396 8.70481 14.9342 6.19304 5.4148 13.3558 9.24757 5.11416 15.3808 6.56633 15.7123 9.38498 20.257 10.2049 13.8696 numMergedOcc 0
18 mol 73 unq 1 iso 0 dist 9.96396 6.19304 5.4148 8.70481 14.9342 13.3558 9.24757 5.11416 6.56633 15.3808 12.016 9.75218 11.6369 10.1207 13.0145 numMergedOcc 0
19 mol 73 unq 1 iso 1 dist 9.96396 8.70481 14.9342 6.19304 5.4148 13.3558 9.24757 5.11416 15.3808 6.56633 12.016 9.75218 10.1207 11.6369 13.0145 numMergedOcc 0
20 mol 85 unq 0 iso 0 dist 6.19965 7.95579 4.26409 7.66905 6.9948 10.7229 7.54568 8.09967 10.2865 4.65335 5.42586 7.97049 11.3023 7.47541 10.0796 numMergedOcc 0
21 mol 85 unq 0 iso 1 dist 6.19965 7.66905 6.9948 7.95579 4.26409 10.7229 7.54568 8.09967 4.65335 10.2865 5.42586 7.97049 7.47541 11.3023 10.0796 numMergedOcc 0
22 mol 85 unq 1 iso 0 dist 7.66905 7.95579 10.7229 6.19965 6.9948 4.26409 7.54568 4.65335 10.2865 8.09967 5.42586 7.47541 11.3023 7.97049 10.0796 numMergedOcc 0
23 mol 85 unq 1 iso 1 dist 7.66905 6.19965 6.9948 7.95579 10.7229 4.26409 7.54568 4.65335 8.09967 10.2865 5.42586 7.47541 7.97049 11.3023 10.0796 numMergedOcc 0
24 mol 85 unq 2 iso 0 dist 7.66905 7.95579 10.7229 6.19965 6.9948 4.26409 7.54568 4.65335 10.2865 8.09967 10.1164 5.73196 15.309 11.2656 9.39864 numMergedOcc 0
25 mol 85 unq 2 iso 1 dist 7.66905 6.19965 6.9948 7.95579 10.7229 4.26409 7.54568 4.65335 8.09967 10.2865 10.1164 5.73196 11.2656 15.309 9.39864 numMergedOcc 0
26 mol 95 unq 0 iso 0 dist 8.03644 9.03572 16.6055 8.83255 13.8105 6.59319 9.49454 11.4333 13.3662 12.0666 8.41707 7.27724 16.9836 16.9811 12.1092 numMergedOcc 0
27 mol 95 unq 0 iso 1 dist 8.03644 8.83255 13.8105 9.03572 16.6055 6.59319 9.49454 11.4333 12.0666 13.3662 8.41707 7.27724 16.9811 16.9836 12.1092 numMergedOcc 0
28 mol 100 unq 0 iso 0 dist 9.60661 7.17106 11.5403 9.35224 7.80879 8.87654 7.01812 5.80144 8.4128 10.0456 5.88134 6.65086 10.5134 6.56369 8.30845 numMergedOcc 0
29 mol 100 unq 0 iso 1 dist 9.60661 9.35224 7.80879 7.17106 11.5403 8.87654 7.01812 5.80144 10.0456 8.4128 5.88134 6.65086 6.56369 10.5134 8.30845 numMergedOcc 0
30 mol 100 unq 1 iso 0 dist 9.35224 9.60661 7.80879 7.17106 8.87654 11.5403 7.01812 10.0456 5.80144 8.4128 5.88134 6.56369 6.65086 10.5134 8.30845 numMergedOcc 0
31 mol 100 unq 1 iso 1 dist 9.35224 7.17106 8.87654 9.60661 7.80879 11.5403 7.01812 10.0456 8.4128 5.80144 5.88134 6.56369 10.5134 6.65086 8.30845 numMergedOcc 0
32 mol 100 unq 2 iso 0 dist 7.47343 6.45675 5.33144 8.86688 10.1407 9.71151 7.38135 11.2312 7.11701 7.79768 8.8807 6.65086 10.1409 14.9102 15.4031 numMergedOcc 0
33 mol 100 unq 2 iso 1 dist 7.47343 8.86688 10.1407 6.45675 5.33144 9.71151 7.38135 11.2312 7.79768 7.11701 8.8807 6.65086 14.9102 10.1409 15.4031 numMergedOcc 0
34 mol 100 unq 3 iso 0 dist 7.47343 6.45675 5.33144 8.86688 10.1407 9.71151 7.38135 11.2312 7.11701 7.79768 12.6515 6.56369 11.8665 13.6959 17.2419 numMergedOcc 0
35 mol 100 unq 3 iso 1 dist 7.47343 8.86688 10.1407 6.45675 5.33144 9.71151 7.38135 11.2312 7.79768 7.11701 12.6515 6.56369 13.6959 11.8665 17.2419 numMergedOcc 0
36 mol 100 unq 4 iso 0 dist 7.47343 6.45675 5.33144 8.86688 10.1407 9.71151 7.38135 11.2312 7.11701 7.79768 13.887 9.30209 13.912 18.2109 19.8941 numMergedOcc 0
37 mol 100 unq 4 iso 1 dist 7.47343 8.86688 10.1407 6.45675 5.33144 9.71151 7.38135 11.2312 7.79768 7.11701 13.887 9.30209 18.2109 13.912 19.8941 numMergedOcc 0
38 mol 100 unq 5 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 8.30845 12.2861 5.80144 10.0456 5.33144 6.45675 10.1409 11.8665 10.6086 numMergedOcc 0
39 mol 100 unq 5 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 8.30845 12.2861 10.0456 5.80144 5.33144 6.45675 11.8665 10.1409 10.6086 numMergedOcc 0
40 mol 100 unq 6 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 8.30845 12.2861 5.80144 10.0456 10.1407 8.86688 14.9102 13.6959 18.1777 numMergedOcc 0
41 mol 100 unq 6 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 8.30845 12.2861 10.0456 5.80144 10.1407 8.86688 13.6959 14.9102 18.1777 numMergedOcc 0
42 mol 100 unq 7 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 8.76378 15.5385 12.3577 4.97045 5.33144 6.45675 10.1409 11.8665 13.2102 numMergedOcc 0
43 mol 100 unq 7 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 8.76378 15.5385 4.97045 12.3577 5.33144 6.45675 11.8665 10.1409 13.2102 numMergedOcc 0
44 mol 100 unq 8 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 8.76378 15.5385 12.3577 4.97045 10.1407 8.86688 14.9102 13.6959 14.0386 numMergedOcc 0
45 mol 100 unq 8 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 8.76378 15.5385 4.97045 12.3577 10.1407 8.86688 13.6959 14.9102 14.0386 numMergedOcc 0
46 mol 100 unq 9 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 8.30845 12.2861 5.80144 6.70236 5.33144 6.45675 10.1409 13.912 10.6086 numMergedOcc 0
47 mol 100 unq 9 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 8.30845 12.2861 6.70236 5.80144 5.33144 6.45675 13.912 10.1409 10.6086 numMergedOcc 0
48 mol 100 unq 10 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 8.30845 12.2861 5.80144 6.70236 10.1407 8.86688 14.9102 18.2109 18.1777 numMergedOcc 0
49 mol 100 unq 10 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 8.30845 12.2861 6.70236 5.80144 10.1407 8.86688 18.2109 14.9102 18.1777 numMergedOcc 0
50 mol 100 unq 11 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 8.76378 15.5385 12.3577 10.7791 5.33144 6.45675 10.1409 13.912 13.2102 numMergedOcc 0
51 mol 100 unq 11 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 8.76378 15.5385 10.7791 12.3577 5.33144 6.45675 13.912 10.1409 13.2102 numMergedOcc 0
52 mol 100 unq 12 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 8.76378 15.5385 12.3577 10.7791 10.1407 8.86688 14.9102 18.2109 14.0386 numMergedOcc 0
53 mol 100 unq 12 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 8.76378 15.5385 10.7791 12.3577 10.1407 8.86688 18.2109 14.9102 14.0386 numMergedOcc 0
54 mol 100 unq 9 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 8.30845 12.2861 10.0456 6.70236 5.33144 6.45675 11.8665 13.912 10.6086 numMergedOcc 0
55 mol 100 unq 9 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 8.30845 12.2861 6.70236 10.0456 5.33144 6.45675 13.912 11.8665 10.6086 numMergedOcc 0
56 mol 100 unq 10 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 8.30845 12.2861 10.0456 6.70236 10.1407 8.86688 13.6959 18.2109 18.1777 numMergedOcc 0
57 mol 100 unq 10 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 8.30845 12.2861 6.70236 10.0456 10.1407 8.86688 18.2109 13.6959 18.1777 numMergedOcc 0
58 mol 100 unq 11 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 8.76378 15.5385 4.97045 10.7791 5.33144 6.45675 11.8665 13.912 13.2102 numMergedOcc 0
59 mol 100 unq 11 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 8.76378 15.5385 10.7791 4.97045 5.33144 6.45675 13.912 11.8665 13.2102 numMergedOcc 0
60 mol 100 unq 12 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 8.76378 15.5385 4.97045 10.7791 10.1407 8.86688 13.6959 18.2109 14.0386 numMergedOcc 0
61 mol 100 unq 12 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 8.76378 15.5385 10.7791 4.97045 10.1407 8.86688 18.2109 13.6959 14.0386 numMergedOcc 0
62 mol 100 unq 13 iso 0 dist 6.65086 7.47343 8.8807 6.56369 7.80879 12.6515 8.30845 5.80144 12.2861 10.0456 5.88134 9.60661 12.0662 9.35224 7.01812 numMergedOcc 0
63 mol 100 unq 13 iso 1 dist 6.65086 6.56369 7.80879 7.47343 8.8807 12.6515 8.30845 5.80144 10.0456 12.2861 5.88134 9.60661 9.35224 12.0662 7.01812 numMergedOcc 0
64 mol 100 unq 14 iso 0 dist 6.65086 7.47343 8.8807 6.56369 7.80879 12.6515 8.76378 12.3577 15.5385 4.97045 5.88134 9.60661 12.0662 9.35224 10.0635 numMergedOcc 0
65 mol 100 unq 14 iso 1 dist 6.65086 6.56369 7.80879 7.47343 8.8807 12.6515 8.76378 12.3577 4.97045 15.5385 5.88134 9.60661 9.35224 12.0662 10.0635 numMergedOcc 0
66 mol 100 unq 15 iso 0 dist 6.65086 7.47343 8.8807 9.30209 5.38414 13.887 8.30845 5.80144 12.2861 6.70236 5.88134 9.60661 12.0662 10.5853 7.01812 numMergedOcc 0
67 mol 100 unq 15 iso 1 dist 6.65086 9.30209 5.38414 7.47343 8.8807 13.887 8.30845 5.80144 6.70236 12.2861 5.88134 9.60661 10.5853 12.0662 7.01812 numMergedOcc 0
68 mol 100 unq 16 iso 0 dist 6.65086 7.47343 8.8807 9.30209 5.38414 13.887 8.76378 12.3577 15.5385 10.7791 5.88134 9.60661 12.0662 10.5853 10.0635 numMergedOcc 0
69 mol 100 unq 16 iso 1 dist 6.65086 9.30209 5.38414 7.47343 8.8807 13.887 8.76378 12.3577 10.7791 15.5385 5.88134 9.60661 10.5853 12.0662 10.0635 numMergedOcc 0
70 mol 100 unq 15 iso 0 dist 6.65086 6.56369 7.80879 9.30209 5.38414 6.39938 8.30845 5.80144 10.0456 6.70236 5.88134 9.60661 9.35224 10.5853 7.01812 numMergedOcc 0
71 mol 100 unq 15 iso 1 dist 6.65086 9.30209 5.38414 6.56369 7.80879 6.39938 8.30845 5.80144 6.70236 10.0456 5.88134 9.60661 10.5853 9.35224 7.01812 numMergedOcc 0
72 mol 100 unq 16 iso 0 dist 6.65086 6.56369 7.80879 9.30209 5.38414 6.39938 8.76378 12.3577 4.97045 10.7791 5.88134 9.60661 9.35224 10.5853 10.0635 numMergedOcc 0
73 mol 100 unq 16 iso 1 dist 6.65086 9.30209 5.38414 6.56369 7.80879 6.39938 8.76378 12.3577 10.7791 4.97045 5.88134 9.60661 10.5853 9.35224 10.0635 numMergedOcc 0
74 mol 100 unq 17 iso 0 dist 6.56369 7.47343 12.6515 6.65086 7.80879 8.8807 8.30845 10.0456 12.2861 5.80144 5.88134 9.35224 12.0662 9.60661 7.01812 numMergedOcc 0
75 mol 100 unq 17 iso 1 dist 6.56369 6.65086 7.80879 7.47343 12.6515 8.8807 8.30845 10.0456 5.80144 12.2861 5.88134 9.35224 9.60661 12.0662 7.01812 numMergedOcc 0
76 mol 100 unq 18 iso 0 dist 6.56369 7.47343 12.6515 6.65086 7.80879 8.8807 8.76378 4.97045 15.5385 12.3577 5.88134 9.35224 12.0662 9.60661 10.0635 numMergedOcc 0
77 mol 100 unq 18 iso 1 dist 6.56369 6.65086 7.80879 7.47343 12.6515 8.8807 8.76378 4.97045 12.3577 15.5385 5.88134 9.35224 9.60661 12.0662 10.0635 numMergedOcc 0
78 mol 100 unq 19 iso 0 dist 6.56369 7.47343 12.6515 9.30209 6.39938 13.887 8.30845 10.0456 12.2861 6.70236 5.88134 9.35224 12.0662 10.5853 7.01812 numMergedOcc 0
79 mol 100 unq 19 iso 1 dist 6.56369 9.30209 6.39938 7.47343 12.6515 13.887 8.30845 10.0456 6.70236 12.2861 5.88134 9.35224 10.5853 12.0662 7.01812 numMergedOcc 0
80 mol 100 unq 20 iso 0 dist 6.56369 7.47343 12.6515 9.30209 6.39938 13.887 8.76378 4.97045 15.5385 10.7791 5.88134 9.35224 12.0662 10.5853 10.0635 numMergedOcc 0
81 mol 100 unq 20 iso 1 dist 6.56369 9.30209 6.39938 7.47343 12.6515 13.887 8.76378 4.97045 10.7791 15.5385 5.88134 9.35224 10.5853 12.0662 10.0635 numMergedOcc 0
82 mol 100 unq 19 iso 0 dist 6.56369 6.65086 7.80879 9.30209 6.39938 5.38414 8.30845 10.0456 5.80144 6.70236 5.88134 9.35224 9.60661 10.5853 7.01812 numMergedOcc 0
83 mol 100 unq 19 iso 1 dist 6.56369 9.30209 6.39938 6.65086 7.80879 5.38414 8.30845 10.0456 6.70236 5.80144 5.88134 9.35224 10.5853 9.60661 7.01812 numMergedOcc 0
84 mol 100 unq 20 iso 0 dist 6.56369 6.65086 7.80879 9.30209 6.39938 5.38414 8.76378 4.97045 12.3577 10.7791 5.88134 9.35224 9.60661 10.5853 10.0635 numMergedOcc 0
85 mol 100 unq 20 iso 1 dist 6.56369 9.30209 6.39938 6.65086 7.80879 5.38414 8.76378 4.97045 10.7791 12.3577 5.88134 9.35224 10.5853 9.60661 10.0635 numMergedOcc 0
86 mol 134 unq 0 iso 0 dist 8.94367 6.37586 5.49782 6.49416 8.80819 5.00817 6.23142 4.57832 5.29786 5.71679 6.81259 9.86662 9.71307 12.5075 9.94764 numMergedOcc 0
87 mol 134 unq 0 iso 1 dist 8.94367 6.49416 8.80819 6.37586 5.49782 5.00817 6.23142 4.57832 5.71679 5.29786 6.81259 9.86662 12.5075 9.71307 9.94764 numMergedOcc 0
88 mol 134 unq 1 iso 0 dist 6.37586 8.94367 5.49782 6.49416 5.00817 8.80819 6.23142 5.29786 4.57832 5.71679 6.81259 9.71307 9.86662 12.5075 9.94764 numMergedOcc 0
89 mol 134 unq 1 iso 1 dist 6.37586 6.49416 5.00817 8.94367 5.49782 8.80819 6.23142 5.29786 5.71679 4.57832 6.81259 9.71307 12.5075 9.86662 9.94764 numMergedOcc 0
90 mol 134 unq 2 iso 0 dist 6.49416 8.94367 8.80819 6.37586 5.00817 5.49782 6.23142 5.71679 4.57832 5.29786 5.00526 6.54501 11.9139 9.5126 7.69991 numMergedOcc 0
91 mol 134 unq 2 iso 1 dist 6.49416 6.37586 5.00817 8.94367 8.80819 5.49782 6.23142 5.71679 5.29786 4.57832 5.00526 6.54501 9.5126 11.9139 7.69991 numMergedOcc 0
92 mol 156 unq 0 iso 0 dist 8.94056 7.44554 5.56175 9.83699 11.2719 8.38403 9.4013 6.13574 5.71511 5.80008 10.1658 7.66148 12.0598 15.1382 11.1147 numMergedOcc 0
93 mol 156 unq 0 iso 1 dist 8.94056 9.83699 11.2719 7.44554 5.56175 8.38403 9.4013 6.13574 5.80008 5.71511 10.1658 7.66148 15.1382 12.0598 11.1147 numMergedOcc 0
94 mol 181 unq 0 iso 0 dist 9.1374 5.98885 8.88798 9.15386 12.1628 5.16002 8.90963 8.91338 9.81073 9.34211 13.2049 8.03334 10.7062 14.9794 16.082 numMergedOcc 0
95 mol 181 unq 0 iso 1 dist 9.1374 9.15386 12.1628 5.98885 8.88798 5.16002 8.90963 8.91338 9.34211 9.81073 13.2049 8.03334 14.9794 10.7062 16.082 numMergedOcc 0
96 mol 181 unq 1 iso 0 dist 5.98885 9.1374 8.88798 9.15386 5.16002 12.1628 8.90963 9.81073 8.91338 9.34211 10.1912 9.09537 15.0228 12.9862 18.0578 numMergedOcc 0
97 mol 181 unq 1 iso 1 dist 5.98885 9.15386 5.16002 9.1374 8.88798 12.1628 8.90963 9.81073 9.34211 8.91338 10.1912 9.09537 12.9862 15.0228 18.0578 numMergedOcc 0
98 mol 227 unq 0 iso 0 dist 7.22101 9.34734 6.99063 8.65997 5.22356 7.60506 7.43071 6.35849 6.00424 10.204 4.39704 7.09863 10.4905 10.8157 6.02296 numMergedOcc 0
99 mol 227 unq 0 iso 1 dist 7.22101 8.65997 5.22356 9.34734 6.99063 7.60506 7.43071 6.35849 10.204 6.00424 4.39704 7.09863 10.8157 10.4905 6.02296 numMergedOcc 0
100 mol 227 unq 1 iso 0 dist 7.22101 9.34734 6.99063 8.65997 5.22356 7.60506 5.41321 10.9607 10.7656 9.72615 4.39704 7.09863 10.4905 10.8157 9.74265 numMergedOcc 0
101 mol 227 unq 1 iso 1 dist 7.22101 8.65997 5.22356 9.34734 6.99063 7.60506 5.41321 10.9607 9.72615 10.7656 4.39704 7.09863 10.8157 10.4905 9.74265 numMergedOcc 0
102 mol 227 unq 2 iso 0 dist 7.22101 9.34734 6.99063 7.56888 10.8658 7.43198 7.43071 6.35849 6.00424 9.76735 4.39704 7.09863 10.4905 11.0431 6.02296 numMergedOcc 0
103 mol 227 unq 2 iso 1 dist 7.22101 7.56888 10.8658 9.34734 6.99063 7.43198 7.43071 6.35849 9.76735 6.00424 4.39704 7.09863 11.0431 10.4905 6.02296 numMergedOcc 0
104 mol 227 unq 3 iso 0 dist 7.22101 9.34734 6.99063 7.56888 10.8658 7.43198 5.41321 10.9607 10.7656 5.10635 4.39704 7.09863 10.4905 11.0431 9.74265 numMergedOcc 0
105 mol 227 unq 3 iso 1 dist 7.22101 7.56888 10.8658 9.34734 6.99063 7.43198 5.41321 10.9607 5.10635 10.7656 4.39704 7.09863 11.0431 10.4905 9.74265 numMergedOcc 0
106 mol 227 unq 4 iso 0 dist 7.22101 9.34734 6.99063 7.55216 12.4689 9.51866 7.43071 6.35849 6.00424 9.32448 4.39704 7.09863 10.4905 10.0334 6.02296 numMergedOcc 0
107 mol 227 unq 4 iso 1 dist 7.22101 7.55216 12.4689 9.34734 6.99063 9.51866 7.43071 6.35849 9.32448 6.00424 4.39704 7.09863 10.0334 10.4905 6.02296 numMergedOcc 0
108 mol 227 unq 5 iso 0 dist 7.22101 9.34734 6.99063 7.55216 12.4689 9.51866 5.41321 10.9607 10.7656 6.48027 4.39704 7.09863 10.4905 10.0334 9.74265 numMergedOcc 0
109 mol 227 unq 5 iso 1 dist 7.22101 7.55216 12.4689 9.34734 6.99063 9.51866 5.41321 10.9607 6.48027 10.7656 4.39704 7.09863 10.0334 10.4905 9.74265 numMergedOcc 0
110 mol 227 unq 2 iso 0 dist 7.22101 8.65997 5.22356 7.56888 10.8658 9.70012 7.43071 6.35849 10.204 9.76735 4.39704 7.09863 10.8157 11.0431 6.02296 numMergedOcc 0
111 mol 227 unq 2 iso 1 dist 7.22101 7.56888 10.8658 8.65997 5.22356 9.70012 7.43071 6.35849 9.76735 10.204 4.39704 7.09863 11.0431 10.8157 6.02296 numMergedOcc 0
112 mol 227 unq 3 iso 0 dist 7.22101 8.65997 5.22356 7.56888 10.8658 9.70012 5.41321 10.9607 9.72615 5.10635 4.39704 7.09863 10.8157 11.0431 9.74265 numMergedOcc 0
113 mol 227 unq 3 iso 1 dist 7.22101 7.56888 10.8658 8.65997 5.22356 9.70012 5.41321 10.9607 5.10635 9.72615 4.39704 7.09863 11.0431 10.8157 9.74265 numMergedOcc 0
114 mol 227 unq 4 iso 0 dist 7.22101 8.65997 5.22356 7.55216 12.4689 12.9332 7.43071 6.35849 10.204 9.32448 4.39704 7.09863 10.8157 10.0334 6.02296 numMergedOcc 0
115 mol 227 unq 4 iso 1 dist 7.22101 7.55216 12.4689 8.65997 5.22356 12.9332 7.43071 6.35849 9.32448 10.204 4.39704 7.09863 10.0334 10.8157 6.02296 numMergedOcc 0
116 mol 227 unq 5 iso 0 dist 7.22101 8.65997 5.22356 7.55216 12.4689 12.9332 5.41321 10.9607 9.72615 6.48027 4.39704 7.09863 10.8157 10.0334 9.74265 numMergedOcc 0
117 mol 227 unq 5 iso 1 dist 7.22101 7.55216 12.4689 8.65997 5.22356 12.9332 5.41321 10.9607 6.48027 9.72615 4.39704 7.09863 10.0334 10.8157 9.74265 numMergedOcc 0
118 mol 227 unq 4 iso 0 dist 7.22101 7.56888 10.8658 7.55216 12.4689 4.48529 7.43071 6.35849 9.76735 9.32448 4.39704 7.09863 11.0431 10.0334 6.02296 numMergedOcc 0
119 mol 227 unq 4 iso 1 dist 7.22101 7.55216 12.4689 7.56888 10.8658 4.48529 7.43071 6.35849 9.32448 9.76735 4.39704 7.09863 10.0334 11.0431 6.02296 numMergedOcc 0
120 mol 227 unq 5 iso 0 dist 7.22101 7.56888 10.8658 7.55216 12.4689 4.48529 5.41321 10.9607 5.10635 6.48027 4.39704 7.09863 11.0431 10.0334 9.74265 numMergedOcc 0
121 mol 227 unq 5 iso 1 dist 7.22101 7.55216 12.4689 7.56888 10.8658 4.48529 5.41321 10.9607 6.48027 5.10635 4.39704 7.09863 10.0334 11.0431 9.74265 numMergedOcc 0
122 mol 234 unq 0 iso 0 dist 6.56247 8.34494 6.29886 9.36357 7.82322 12.1694 9.81425 4.46561 4.3717 10.641 5.88703 9.45496 12.9605 6.7625 13.293 numMergedOcc 0
123 mol 234 unq 0 iso 1 dist 6.56247 9.36357 7.82322 8.34494 6.29886 12.1694 9.81425 4.46561 10.641 4.3717 5.88703 9.45496 6.7625 12.9605 13.293 numMergedOcc 0
124 mol 234 unq 1 iso 0 dist 9.36357 8.34494 12.1694 6.56247 7.82322 6.29886 9.81425 10.641 4.3717 4.46561 5.88703 6.7625 12.9605 9.45496 13.293 numMergedOcc 0
125 mol 234 unq 1 iso 1 dist 9.36357 6.56247 7.82322 8.34494 12.1694 6.29886 9.81425 10.641 4.46561 4.3717 5.88703 6.7625 9.45496 12.9605 13.293 numMergedOcc 0
126 mol 261 unq 0 iso 0 dist 8.43057 8.02547 10.0727 6.05727 4.63549 5.51688 8.43974 8.29908 5.91643 5.02383 10.1239 7.73141 14.2688 10.0703 14.8495 numMergedOcc 0
127 mol 261 unq 0 iso 1 dist 8.43057 6.05727 4.63549 8.02547 10.0727 5.51688 8.43974 8.29908 5.02383 5.91643 10.1239 7.73141 10.0703 14.2688 14.8495 numMergedOcc 0
