0 mol 19 unq 0 iso 0 dist 7.20519 4.54938 7.34551 6.864 7.07775 5.80928 7.75618 4.96411 9.74255 7.08342 numMergedOcc 0
1 mol 19 unq 0 iso 1 dist 7.20519 6.864 7.07775 4.54938 7.34551 5.80928 7.75618 4.96411 7.08342 9.74255 numMergedOcc 0
2 mol 19 unq 0 iso 2 dist 4.54938 7.20519 7.34551 6.864 5.80928 7.07775 7.75618 9.74255 4.96411 7.08342 numMergedOcc 0
3 mol 19 unq 0 iso 3 dist 4.54938 6.864 5.80928 7.20519 7.34551 7.07775 7.75618 9.74255 7.08342 4.96411 numMergedOcc 0
4 mol 19 unq 0 iso 4 dist 6.864 7.20519 7.07775 4.54938 5.80928 7.34551 7.75618 7.08342 4.96411 9.74255 numMergedOcc 0
5 mol 19 unq 0 iso 5 dist 6.864 4.54938 5.80928 7.20519 7.07775 7.34551 7.75618 7.08342 9.74255 4.96411 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 8.4674 4.54938 7.67038 7.82074 10.3915 5.03957 6.41575 4.64838 4.97119 6.01808 numMergedOcc 0
7 mol 19 unq 1 iso 1 dist 8.4674 7.82074 10.3915 4.54938 7.67038 5.03957 6.41575 4.64838 6.01808 4.97119 numMergedOcc 0
8 mol 19 unq 1 iso 2 dist 4.54938 8.4674 7.67038 7.82074 5.03957 10.3915 6.41575 4.97119 4.64838 6.01808 numMergedOcc 0
9 mol 19 unq 1 iso 3 dist 4.54938 7.82074 5.03957 8.4674 7.67038 10.3915 6.41575 4.97119 6.01808 4.64838 numMergedOcc 0
10 mol 19 unq 1 iso 4 dist 7.82074 8.4674 10.3915 4.54938 5.03957 7.67038 6.41575 6.01808 4.64838 4.97119 numMergedOcc 0
11 mol 19 unq 1 iso 5 dist 7.82074 4.54938 5.03957 8.4674 10.3915 7.67038 6.41575 6.01808 4.97119 4.64838 numMergedOcc 0
12 mol 54 unq 0 iso 0 dist 9.5589 6.83299 5.08001 8.10861 16.3192 14.2075 7.21717 15.293 13.86 5.99981 numMergedOcc 0
13 mol 54 unq 0 iso 1 dist 9.5589 8.10861 16.3192 6.83299 5.08001 14.2075 7.21717 15.293 5.99981 13.86 numMergedOcc 0
14 mol 54 unq 0 iso 2 dist 6.83299 9.5589 5.08001 8.10861 14.2075 16.3192 7.21717 13.86 15.293 5.99981 numMergedOcc 0
15 mol 54 unq 0 iso 3 dist 6.83299 8.10861 14.2075 9.5589 5.08001 16.3192 7.21717 13.86 5.99981 15.293 numMergedOcc 0
16 mol 54 unq 0 iso 4 dist 8.10861 9.5589 16.3192 6.83299 14.2075 5.08001 7.21717 5.99981 15.293 13.86 numMergedOcc 0
17 mol 54 unq 0 iso 5 dist 8.10861 6.83299 14.2075 9.5589 16.3192 5.08001 7.21717 5.99981 13.86 15.293 numMergedOcc 0
18 mol 58 unq 0 iso 0 dist 6.81627 7.32874 5.47421 9.55426 9.7274 5.90225 7.21955 7.09066 7.12541 5.74871 numMergedOcc 0
19 mol 58 unq 0 iso 1 dist 6.81627 9.55426 9.7274 7.32874 5.47421 5.90225 7.21955 7.09066 5.74871 7.12541 numMergedOcc 0
20 mol 58 unq 0 iso 2 dist 7.32874 6.81627 5.47421 9.55426 5.90225 9.7274 7.21955 7.12541 7.09066 5.74871 numMergedOcc 0
21 mol 58 unq 0 iso 3 dist 7.32874 9.55426 5.90225 6.81627 5.47421 9.7274 7.21955 7.12541 5.74871 7.09066 numMergedOcc 0
22 mol 58 unq 0 iso 4 dist 9.55426 6.81627 9.7274 7.32874 5.90225 5.47421 7.21955 5.74871 7.09066 7.12541 numMergedOcc 0
23 mol 58 unq 0 iso 5 dist 9.55426 7.32874 5.90225 6.81627 9.7274 5.47421 7.21955 5.74871 7.12541 7.09066 numMergedOcc 0
24 mol 58 unq 1 iso 0 dist 6.86465 6.62496 5.30792 6.35756 5.35073 4.81926 8.80614 10.2049 9.95364 5.49591 numMergedOcc 0
25 mol 58 unq 1 iso 1 dist 6.86465 6.35756 5.35073 6.62496 5.30792 4.81926 8.80614 10.2049 5.49591 9.95364 numMergedOcc 0
26 mol 58 unq 1 iso 2 dist 6.62496 6.86465 5.30792 6.35756 4.81926 5.35073 8.80614 9.95364 10.2049 5.49591 numMergedOcc 0
27 mol 58 unq 1 iso 3 dist 6.62496 6.35756 4.81926 6.86465 5.30792 5.35073 8.80614 9.95364 5.49591 10.2049 numMergedOcc 0
28 mol 58 unq 1 iso 4 dist 6.35756 6.86465 5.35073 6.62496 4.81926 5.30792 8.80614 5.49591 10.2049 9.95364 numMergedOcc 0
29 mol 58 unq 1 iso 5 dist 6.35756 6.62496 4.81926 6.86465 5.35073 5.30792 8.80614 5.49591 9.95364 10.2049 numMergedOcc 0
30 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 numMergedOcc 0
31 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 numMergedOcc 0
32 mol 59 unq 0 iso 2 dist 8.84665 7.71095 12.5396 8.25513 6.40295 8.19458 6.73347 4.36133 9.64444 6.66692 numMergedOcc 0
33 mol 59 unq 0 iso 3 dist 8.84665 8.25513 6.40295 7.71095 12.5396 8.19458 6.73347 4.36133 6.66692 9.64444 numMergedOcc 0
34 mol 59 unq 0 iso 4 dist 8.25513 7.71095 8.19458 8.84665 6.40295 12.5396 6.73347 6.66692 9.64444 4.36133 numMergedOcc 0
35 mol 59 unq 0 iso 5 dist 8.25513 8.84665 6.40295 7.71095 8.19458 12.5396 6.73347 6.66692 4.36133 9.64444 numMergedOcc 0
36 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 numMergedOcc 0
37 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 numMergedOcc 0
38 mol 73 unq 0 iso 2 dist 6.19304 9.96396 5.4148 8.70481 13.3558 14.9342 9.24757 6.56633 5.11416 15.3808 numMergedOcc 0
39 mol 73 unq 0 iso 3 dist 6.19304 8.70481 13.3558 9.96396 5.4148 14.9342 9.24757 6.56633 15.3808 5.11416 numMergedOcc 0
40 mol 73 unq 0 iso 4 dist 8.70481 9.96396 14.9342 6.19304 13.3558 5.4148 9.24757 15.3808 5.11416 6.56633 numMergedOcc 0
41 mol 73 unq 0 iso 5 dist 8.70481 6.19304 13.3558 9.96396 14.9342 5.4148 9.24757 15.3808 6.56633 5.11416 numMergedOcc 0
42 mol 85 unq 0 iso 0 dist 7.95579 6.19965 4.26409 7.66905 10.7229 6.9948 7.54568 10.2865 8.09967 4.65335 numMergedOcc 0
43 mol 85 unq 0 iso 1 dist 7.95579 7.66905 10.7229 6.19965 4.26409 6.9948 7.54568 10.2865 4.65335 8.09967 numMergedOcc 0
44 mol 85 unq 0 iso 2 dist 6.19965 7.95579 4.26409 7.66905 6.9948 10.7229 7.54568 8.09967 10.2865 4.65335 numMergedOcc 0
45 mol 85 unq 0 iso 3 dist 6.19965 7.66905 6.9948 7.95579 4.26409 10.7229 7.54568 8.09967 4.65335 10.2865 numMergedOcc 0
46 mol 85 unq 0 iso 4 dist 7.66905 7.95579 10.7229 6.19965 6.9948 4.26409 7.54568 4.65335 10.2865 8.09967 numMergedOcc 0
47 mol 85 unq 0 iso 5 dist 7.66905 6.19965 6.9948 7.95579 10.7229 4.26409 7.54568 4.65335 8.09967 10.2865 numMergedOcc 0
48 mol 95 unq 0 iso 0 dist 9.03572 8.83255 6.59319 8.03644 16.6055 13.8105 9.49454 13.3662 12.0666 11.4333 numMergedOcc 0
49 mol 95 unq 0 iso 1 dist 9.03572 8.03644 16.6055 8.83255 6.59319 13.8105 9.49454 13.3662 11.4333 12.0666 numMergedOcc 0
50 mol 95 unq 0 iso 2 dist 8.83255 9.03572 6.59319 8.03644 13.8105 16.6055 9.49454 12.0666 13.3662 11.4333 numMergedOcc 0
51 mol 95 unq 0 iso 3 dist 8.83255 8.03644 13.8105 9.03572 6.59319 16.6055 9.49454 12.0666 11.4333 13.3662 numMergedOcc 0
52 mol 95 unq 0 iso 4 dist 8.03644 9.03572 16.6055 8.83255 13.8105 6.59319 9.49454 11.4333 13.3662 12.0666 numMergedOcc 0
53 mol 95 unq 0 iso 5 dist 8.03644 8.83255 13.8105 9.03572 16.6055 6.59319 9.49454 11.4333 12.0666 13.3662 numMergedOcc 0
54 mol 98 unq 0 iso 0 dist 5.08437 6.48948 9.51923 6.10456 8.40073 9.42358 6.65501 4.4057 7.42446 9.67482 numMergedOcc 0
55 mol 98 unq 0 iso 1 dist 5.08437 6.10456 8.40073 6.48948 9.51923 9.42358 6.65501 4.4057 9.67482 7.42446 numMergedOcc 0
56 mol 98 unq 0 iso 2 dist 6.48948 5.08437 9.51923 6.10456 9.42358 8.40073 6.65501 7.42446 4.4057 9.67482 numMergedOcc 0
57 mol 98 unq 0 iso 3 dist 6.48948 6.10456 9.42358 5.08437 9.51923 8.40073 6.65501 7.42446 9.67482 4.4057 numMergedOcc 0
58 mol 98 unq 0 iso 4 dist 6.10456 5.08437 8.40073 6.48948 9.42358 9.51923 6.65501 9.67482 4.4057 7.42446 numMergedOcc 0
59 mol 98 unq 0 iso 5 dist 6.10456 6.48948 9.42358 5.08437 8.40073 9.51923 6.65501 9.67482 7.42446 4.4057 numMergedOcc 0
60 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 numMergedOcc 0
61 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 numMergedOcc 0
62 mol 100 unq 0 iso 2 dist 7.17106 9.60661 11.5403 9.35224 8.87654 7.80879 7.01812 8.4128 5.80144 10.0456 numMergedOcc 0
63 mol 100 unq 0 iso 3 dist 7.17106 9.35224 8.87654 9.60661 11.5403 7.80879 7.01812 8.4128 10.0456 5.80144 numMergedOcc 0
64 mol 100 unq 0 iso 4 dist 9.35224 9.60661 7.80879 7.17106 8.87654 11.5403 7.01812 10.0456 5.80144 8.4128 numMergedOcc 0
65 mol 100 unq 0 iso 5 dist 9.35224 7.17106 8.87654 9.60661 7.80879 11.5403 7.01812 10.0456 8.4128 5.80144 numMergedOcc 0
66 mol 100 unq 1 iso 0 dist 6.45675 7.47343 5.33144 8.86688 9.71151 10.1407 7.38135 7.11701 11.2312 7.79768 numMergedOcc 0
67 mol 100 unq 1 iso 1 dist 6.45675 8.86688 9.71151 7.47343 5.33144 10.1407 7.38135 7.11701 7.79768 11.2312 numMergedOcc 0
68 mol 100 unq 1 iso 2 dist 7.47343 6.45675 5.33144 8.86688 10.1407 9.71151 7.38135 11.2312 7.11701 7.79768 numMergedOcc 0
69 mol 100 unq 1 iso 3 dist 7.47343 8.86688 10.1407 6.45675 5.33144 9.71151 7.38135 11.2312 7.79768 7.11701 numMergedOcc 0
70 mol 100 unq 1 iso 4 dist 8.86688 6.45675 9.71151 7.47343 10.1407 5.33144 7.38135 7.79768 7.11701 11.2312 numMergedOcc 0
71 mol 100 unq 1 iso 5 dist 8.86688 7.47343 10.1407 6.45675 9.71151 5.33144 7.38135 7.79768 11.2312 7.11701 numMergedOcc 0
72 mol 100 unq 2 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 8.30845 12.2861 5.80144 10.0456 numMergedOcc 0
73 mol 100 unq 2 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 8.30845 12.2861 10.0456 5.80144 numMergedOcc 0
74 mol 100 unq 2 iso 2 dist 6.65086 7.47343 8.8807 6.56369 7.80879 12.6515 8.30845 5.80144 12.2861 10.0456 numMergedOcc 0
75 mol 100 unq 2 iso 3 dist 6.65086 6.56369 7.80879 7.47343 8.8807 12.6515 8.30845 5.80144 10.0456 12.2861 numMergedOcc 0
76 mol 100 unq 2 iso 4 dist 6.56369 7.47343 12.6515 6.65086 7.80879 8.8807 8.30845 10.0456 12.2861 5.80144 numMergedOcc 0
77 mol 100 unq 2 iso 5 dist 6.56369 6.65086 7.80879 7.47343 12.6515 8.8807 8.30845 10.0456 5.80144 12.2861 numMergedOcc 0
78 mol 100 unq 3 iso 0 dist 7.47343 6.65086 8.8807 6.56369 12.6515 7.80879 8.76378 15.5385 12.3577 4.97045 numMergedOcc 0
79 mol 100 unq 3 iso 1 dist 7.47343 6.56369 12.6515 6.65086 8.8807 7.80879 8.76378 15.5385 4.97045 12.3577 numMergedOcc 0
80 mol 100 unq 3 iso 2 dist 6.65086 7.47343 8.8807 6.56369 7.80879 12.6515 8.76378 12.3577 15.5385 4.97045 numMergedOcc 0
81 mol 100 unq 3 iso 3 dist 6.65086 6.56369 7.80879 7.47343 8.8807 12.6515 8.76378 12.3577 4.97045 15.5385 numMergedOcc 0
82 mol 100 unq 3 iso 4 dist 6.56369 7.47343 12.6515 6.65086 7.80879 8.8807 8.76378 4.97045 15.5385 12.3577 numMergedOcc 0
83 mol 100 unq 3 iso 5 dist 6.56369 6.65086 7.80879 7.47343 12.6515 8.8807 8.76378 4.97045 12.3577 15.5385 numMergedOcc 0
84 mol 100 unq 4 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 8.30845 12.2861 5.80144 6.70236 numMergedOcc 0
85 mol 100 unq 4 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 8.30845 12.2861 6.70236 5.80144 numMergedOcc 0
86 mol 100 unq 4 iso 2 dist 6.65086 7.47343 8.8807 9.30209 5.38414 13.887 8.30845 5.80144 12.2861 6.70236 numMergedOcc 0
87 mol 100 unq 4 iso 3 dist 6.65086 9.30209 5.38414 7.47343 8.8807 13.887 8.30845 5.80144 6.70236 12.2861 numMergedOcc 0
88 mol 100 unq 4 iso 4 dist 9.30209 7.47343 13.887 6.65086 5.38414 8.8807 8.30845 6.70236 12.2861 5.80144 numMergedOcc 0
89 mol 100 unq 4 iso 5 dist 9.30209 6.65086 5.38414 7.47343 13.887 8.8807 8.30845 6.70236 5.80144 12.2861 numMergedOcc 0
90 mol 100 unq 5 iso 0 dist 7.47343 6.65086 8.8807 9.30209 13.887 5.38414 8.76378 15.5385 12.3577 10.7791 numMergedOcc 0
91 mol 100 unq 5 iso 1 dist 7.47343 9.30209 13.887 6.65086 8.8807 5.38414 8.76378 15.5385 10.7791 12.3577 numMergedOcc 0
92 mol 100 unq 5 iso 2 dist 6.65086 7.47343 8.8807 9.30209 5.38414 13.887 8.76378 12.3577 15.5385 10.7791 numMergedOcc 0
93 mol 100 unq 5 iso 3 dist 6.65086 9.30209 5.38414 7.47343 8.8807 13.887 8.76378 12.3577 10.7791 15.5385 numMergedOcc 0
94 mol 100 unq 5 iso 4 dist 9.30209 7.47343 13.887 6.65086 5.38414 8.8807 8.76378 10.7791 15.5385 12.3577 numMergedOcc 0
95 mol 100 unq 5 iso 5 dist 9.30209 6.65086 5.38414 7.47343 13.887 8.8807 8.76378 10.7791 12.3577 15.5385 numMergedOcc 0
96 mol 100 unq 4 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 8.30845 12.2861 10.0456 6.70236 numMergedOcc 0
97 mol 100 unq 4 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 8.30845 12.2861 6.70236 10.0456 numMergedOcc 0
98 mol 100 unq 4 iso 2 dist 6.56369 7.47343 12.6515 9.30209 6.39938 13.887 8.30845 10.0456 12.2861 6.70236 numMergedOcc 0
99 mol 100 unq 4 iso 3 dist 6.56369 9.30209 6.39938 7.47343 12.6515 13.887 8.30845 10.0456 6.70236 12.2861 numMergedOcc 0
100 mol 100 unq 4 iso 4 dist 9.30209 7.47343 13.887 6.56369 6.39938 12.6515 8.30845 6.70236 12.2861 10.0456 numMergedOcc 0
101 mol 100 unq 4 iso 5 dist 9.30209 6.56369 6.39938 7.47343 13.887 12.6515 8.30845 6.70236 10.0456 12.2861 numMergedOcc 0
102 mol 100 unq 5 iso 0 dist 7.47343 6.56369 12.6515 9.30209 13.887 6.39938 8.76378 15.5385 4.97045 10.7791 numMergedOcc 0
103 mol 100 unq 5 iso 1 dist 7.47343 9.30209 13.887 6.56369 12.6515 6.39938 8.76378 15.5385 10.7791 4.97045 numMergedOcc 0
104 mol 100 unq 5 iso 2 dist 6.56369 7.47343 12.6515 9.30209 6.39938 13.887 8.76378 4.97045 15.5385 10.7791 numMergedOcc 0
105 mol 100 unq 5 iso 3 dist 6.56369 9.30209 6.39938 7.47343 12.6515 13.887 8.76378 4.97045 10.7791 15.5385 numMergedOcc 0
106 mol 100 unq 5 iso 4 dist 9.30209 7.47343 13.887 6.56369 6.39938 12.6515 8.76378 10.7791 15.5385 4.97045 numMergedOcc 0
107 mol 100 unq 5 iso 5 dist 9.30209 6.56369 6.39938 7.47343 13.887 12.6515 8.76378 10.7791 4.97045 15.5385 numMergedOcc 0
108 mol 100 unq 4 iso 0 dist 6.65086 6.56369 7.80879 9.30209 5.38414 6.39938 8.30845 5.80144 10.0456 6.70236 numMergedOcc 0
109 mol 100 unq 4 iso 1 dist 6.65086 9.30209 5.38414 6.56369 7.80879 6.39938 8.30845 5.80144 6.70236 10.0456 numMergedOcc 0
110 mol 100 unq 4 iso 2 dist 6.56369 6.65086 7.80879 9.30209 6.39938 5.38414 8.30845 10.0456 5.80144 6.70236 numMergedOcc 0
111 mol 100 unq 4 iso 3 dist 6.56369 9.30209 6.39938 6.65086 7.80879 5.38414 8.30845 10.0456 6.70236 5.80144 numMergedOcc 0
112 mol 100 unq 4 iso 4 dist 9.30209 6.65086 5.38414 6.56369 6.39938 7.80879 8.30845 6.70236 5.80144 10.0456 numMergedOcc 0
113 mol 100 unq 4 iso 5 dist 9.30209 6.56369 6.39938 6.65086 5.38414 7.80879 8.30845 6.70236 10.0456 5.80144 numMergedOcc 0
114 mol 100 unq 5 iso 0 dist 6.65086 6.56369 7.80879 9.30209 5.38414 6.39938 8.76378 12.3577 4.97045 10.7791 numMergedOcc 0
115 mol 100 unq 5 iso 1 dist 6.65086 9.30209 5.38414 6.56369 7.80879 6.39938 8.76378 12.3577 10.7791 4.97045 numMergedOcc 0
116 mol 100 unq 5 iso 2 dist 6.56369 6.65086 7.80879 9.30209 6.39938 5.38414 8.76378 4.97045 12.3577 10.7791 numMergedOcc 0
117 mol 100 unq 5 iso 3 dist 6.56369 9.30209 6.39938 6.65086 7.80879 5.38414 8.76378 4.97045 10.7791 12.3577 numMergedOcc 0
118 mol 100 unq 5 iso 4 dist 9.30209 6.65086 5.38414 6.56369 6.39938 7.80879 8.76378 10.7791 12.3577 4.97045 numMergedOcc 0
119 mol 100 unq 5 iso 5 dist 9.30209 6.56369 6.39938 6.65086 5.38414 7.80879 8.76378 10.7791 4.97045 12.3577 numMergedOcc 0
120 mol 131 unq 0 iso 0 dist 8.40312 7.12972 5.55373 6.85062 10.7062 6.63273 9.90168 7.7567 8.23791 13.7237 numMergedOcc 0
121 mol 131 unq 0 iso 1 dist 8.40312 6.85062 10.7062 7.12972 5.55373 6.63273 9.90168 7.7567 13.7237 8.23791 numMergedOcc 0
122 mol 131 unq 0 iso 2 dist 7.12972 8.40312 5.55373 6.85062 6.63273 10.7062 9.90168 8.23791 7.7567 13.7237 numMergedOcc 0
123 mol 131 unq 0 iso 3 dist 7.12972 6.85062 6.63273 8.40312 5.55373 10.7062 9.90168 8.23791 13.7237 7.7567 numMergedOcc 0
124 mol 131 unq 0 iso 4 dist 6.85062 8.40312 10.7062 7.12972 6.63273 5.55373 9.90168 13.7237 7.7567 8.23791 numMergedOcc 0
125 mol 131 unq 0 iso 5 dist 6.85062 7.12972 6.63273 8.40312 10.7062 5.55373 9.90168 13.7237 8.23791 7.7567 numMergedOcc 0
126 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 numMergedOcc 0
127 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 numMergedOcc 0
128 mol 134 unq 0 iso 2 dist 6.37586 8.94367 5.49782 6.49416 5.00817 8.80819 6.23142 5.29786 4.57832 5.71679 numMergedOcc 0
129 mol 134 unq 0 iso 3 dist 6.37586 6.49416 5.00817 8.94367 5.49782 8.80819 6.23142 5.29786 5.71679 4.57832 numMergedOcc 0
130 mol 134 unq 0 iso 4 dist 6.49416 8.94367 8.80819 6.37586 5.00817 5.49782 6.23142 5.71679 4.57832 5.29786 numMergedOcc 0
131 mol 134 unq 0 iso 5 dist 6.49416 6.37586 5.00817 8.94367 8.80819 5.49782 6.23142 5.71679 5.29786 4.57832 numMergedOcc 0
132 mol 156 unq 0 iso 0 dist 8.34702 9.06726 6.31306 8.33171 6.56229 5.64555 7.30357 10.4977 12.3086 7.79535 numMergedOcc 0
133 mol 156 unq 0 iso 1 dist 8.34702 8.33171 6.56229 9.06726 6.31306 5.64555 7.30357 10.4977 7.79535 12.3086 numMergedOcc 0
134 mol 156 unq 0 iso 2 dist 9.06726 8.34702 6.31306 8.33171 5.64555 6.56229 7.30357 12.3086 10.4977 7.79535 numMergedOcc 0
135 mol 156 unq 0 iso 3 dist 9.06726 8.33171 5.64555 8.34702 6.31306 6.56229 7.30357 12.3086 7.79535 10.4977 numMergedOcc 0
136 mol 156 unq 0 iso 4 dist 8.33171 8.34702 6.56229 9.06726 5.64555 6.31306 7.30357 7.79535 10.4977 12.3086 numMergedOcc 0
137 mol 156 unq 0 iso 5 dist 8.33171 9.06726 5.64555 8.34702 6.56229 6.31306 7.30357 7.79535 12.3086 10.4977 numMergedOcc 0
138 mol 156 unq 1 iso 0 dist 8.34702 9.06726 6.31306 8.33171 6.56229 5.64555 8.61587 12.4274 10.9151 6.98125 numMergedOcc 0
139 mol 156 unq 1 iso 1 dist 8.34702 8.33171 6.56229 9.06726 6.31306 5.64555 8.61587 12.4274 6.98125 10.9151 numMergedOcc 0
140 mol 156 unq 1 iso 2 dist 9.06726 8.34702 6.31306 8.33171 5.64555 6.56229 8.61587 10.9151 12.4274 6.98125 numMergedOcc 0
141 mol 156 unq 1 iso 3 dist 9.06726 8.33171 5.64555 8.34702 6.31306 6.56229 8.61587 10.9151 6.98125 12.4274 numMergedOcc 0
142 mol 156 unq 1 iso 4 dist 8.33171 8.34702 6.56229 9.06726 5.64555 6.31306 8.61587 6.98125 12.4274 10.9151 numMergedOcc 0
143 mol 156 unq 1 iso 5 dist 8.33171 9.06726 5.64555 8.34702 6.56229 6.31306 8.61587 6.98125 10.9151 12.4274 numMergedOcc 0
144 mol 156 unq 2 iso 0 dist 7.44554 8.94056 5.56175 9.83699 8.38403 11.2719 9.4013 5.71511 6.13574 5.80008 numMergedOcc 0
145 mol 156 unq 2 iso 1 dist 7.44554 9.83699 8.38403 8.94056 5.56175 11.2719 9.4013 5.71511 5.80008 6.13574 numMergedOcc 0
146 mol 156 unq 2 iso 2 dist 8.94056 7.44554 5.56175 9.83699 11.2719 8.38403 9.4013 6.13574 5.71511 5.80008 numMergedOcc 0
147 mol 156 unq 2 iso 3 dist 8.94056 9.83699 11.2719 7.44554 5.56175 8.38403 9.4013 6.13574 5.80008 5.71511 numMergedOcc 0
148 mol 156 unq 2 iso 4 dist 9.83699 7.44554 8.38403 8.94056 11.2719 5.56175 9.4013 5.80008 5.71511 6.13574 numMergedOcc 0
149 mol 156 unq 2 iso 5 dist 9.83699 8.94056 11.2719 7.44554 8.38403 5.56175 9.4013 5.80008 6.13574 5.71511 numMergedOcc 0
150 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 numMergedOcc 0
151 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 numMergedOcc 0
152 mol 181 unq 0 iso 2 dist 5.98885 9.1374 8.88798 9.15386 5.16002 12.1628 8.90963 9.81073 8.91338 9.34211 numMergedOcc 0
153 mol 181 unq 0 iso 3 dist 5.98885 9.15386 5.16002 9.1374 8.88798 12.1628 8.90963 9.81073 9.34211 8.91338 numMergedOcc 0
154 mol 181 unq 0 iso 4 dist 9.15386 9.1374 12.1628 5.98885 5.16002 8.88798 8.90963 9.34211 8.91338 9.81073 numMergedOcc 0
155 mol 181 unq 0 iso 5 dist 9.15386 5.98885 5.16002 9.1374 12.1628 8.88798 8.90963 9.34211 9.81073 8.91338 numMergedOcc 0
156 mol 205 unq 0 iso 0 dist 6.03031 7.26832 7.38516 7.80463 8.18714 13.8543 6.03688 8.15057 12.4957 6.09749 numMergedOcc 0
157 mol 205 unq 0 iso 1 dist 6.03031 7.80463 8.18714 7.26832 7.38516 13.8543 6.03688 8.15057 6.09749 12.4957 numMergedOcc 0
158 mol 205 unq 0 iso 2 dist 7.26832 6.03031 7.38516 7.80463 13.8543 8.18714 6.03688 12.4957 8.15057 6.09749 numMergedOcc 0
159 mol 205 unq 0 iso 3 dist 7.26832 7.80463 13.8543 6.03031 7.38516 8.18714 6.03688 12.4957 6.09749 8.15057 numMergedOcc 0
160 mol 205 unq 0 iso 4 dist 7.80463 6.03031 8.18714 7.26832 13.8543 7.38516 6.03688 6.09749 8.15057 12.4957 numMergedOcc 0
161 mol 205 unq 0 iso 5 dist 7.80463 7.26832 13.8543 6.03031 8.18714 7.38516 6.03688 6.09749 12.4957 8.15057 numMergedOcc 0
162 mol 222 unq 0 iso 0 dist 8.01589 7.7699 10.4579 7.21333 13.3522 5.24516 7.67576 10.3151 7.81022 7.75656 numMergedOcc 0
163 mol 222 unq 0 iso 1 dist 8.01589 7.21333 13.3522 7.7699 10.4579 5.24516 7.67576 10.3151 7.75656 7.81022 numMergedOcc 0
164 mol 222 unq 0 iso 2 dist 7.7699 8.01589 10.4579 7.21333 5.24516 13.3522 7.67576 7.81022 10.3151 7.75656 numMergedOcc 0
165 mol 222 unq 0 iso 3 dist 7.7699 7.21333 5.24516 8.01589 10.4579 13.3522 7.67576 7.81022 7.75656 10.3151 numMergedOcc 0
166 mol 222 unq 0 iso 4 dist 7.21333 8.01589 13.3522 7.7699 5.24516 10.4579 7.67576 7.75656 10.3151 7.81022 numMergedOcc 0
167 mol 222 unq 0 iso 5 dist 7.21333 7.7699 5.24516 8.01589 13.3522 10.4579 7.67576 7.75656 7.81022 10.3151 numMergedOcc 0
168 mol 222 unq 1 iso 0 dist 8.01589 7.7699 10.4579 7.21333 13.3522 5.24516 9.82371 8.52017 15.7504 16.0949 numMergedOcc 0
169 mol 222 unq 1 iso 1 dist 8.01589 7.21333 13.3522 7.7699 10.4579 5.24516 9.82371 8.52017 16.0949 15.7504 numMergedOcc 0
170 mol 222 unq 1 iso 2 dist 7.7699 8.01589 10.4579 7.21333 5.24516 13.3522 9.82371 15.7504 8.52017 16.0949 numMergedOcc 0
171 mol 222 unq 1 iso 3 dist 7.7699 7.21333 5.24516 8.01589 10.4579 13.3522 9.82371 15.7504 16.0949 8.52017 numMergedOcc 0
172 mol 222 unq 1 iso 4 dist 7.21333 8.01589 13.3522 7.7699 5.24516 10.4579 9.82371 16.0949 8.52017 15.7504 numMergedOcc 0
173 mol 222 unq 1 iso 5 dist 7.21333 7.7699 5.24516 8.01589 13.3522 10.4579 9.82371 16.0949 15.7504 8.52017 numMergedOcc 0
174 mol 227 unq 0 iso 0 dist 9.34734 7.22101 6.99063 8.65997 7.60506 5.22356 7.43071 6.00424 6.35849 10.204 numMergedOcc 0
175 mol 227 unq 0 iso 1 dist 9.34734 8.65997 7.60506 7.22101 6.99063 5.22356 7.43071 6.00424 10.204 6.35849 numMergedOcc 0
176 mol 227 unq 0 iso 2 dist 7.22101 9.34734 6.99063 8.65997 5.22356 7.60506 7.43071 6.35849 6.00424 10.204 numMergedOcc 0
177 mol 227 unq 0 iso 3 dist 7.22101 8.65997 5.22356 9.34734 6.99063 7.60506 7.43071 6.35849 10.204 6.00424 numMergedOcc 0
178 mol 227 unq 0 iso 4 dist 8.65997 9.34734 7.60506 7.22101 5.22356 6.99063 7.43071 10.204 6.00424 6.35849 numMergedOcc 0
179 mol 227 unq 0 iso 5 dist 8.65997 7.22101 5.22356 9.34734 7.60506 6.99063 7.43071 10.204 6.35849 6.00424 numMergedOcc 0
180 mol 227 unq 1 iso 0 dist 9.34734 7.22101 6.99063 8.65997 7.60506 5.22356 5.41321 10.7656 10.9607 9.72615 numMergedOcc 0
181 mol 227 unq 1 iso 1 dist 9.34734 8.65997 7.60506 7.22101 6.99063 5.22356 5.41321 10.7656 9.72615 10.9607 numMergedOcc 0
182 mol 227 unq 1 iso 2 dist 7.22101 9.34734 6.99063 8.65997 5.22356 7.60506 5.41321 10.9607 10.7656 9.72615 numMergedOcc 0
183 mol 227 unq 1 iso 3 dist 7.22101 8.65997 5.22356 9.34734 6.99063 7.60506 5.41321 10.9607 9.72615 10.7656 numMergedOcc 0
184 mol 227 unq 1 iso 4 dist 8.65997 9.34734 7.60506 7.22101 5.22356 6.99063 5.41321 9.72615 10.7656 10.9607 numMergedOcc 0
185 mol 227 unq 1 iso 5 dist 8.65997 7.22101 5.22356 9.34734 7.60506 6.99063 5.41321 9.72615 10.9607 10.7656 numMergedOcc 0
186 mol 227 unq 2 iso 0 dist 9.34734 7.22101 6.99063 7.56888 7.43198 10.8658 7.43071 6.00424 6.35849 9.76735 numMergedOcc 0
187 mol 227 unq 2 iso 1 dist 9.34734 7.56888 7.43198 7.22101 6.99063 10.8658 7.43071 6.00424 9.76735 6.35849 numMergedOcc 0
188 mol 227 unq 2 iso 2 dist 7.22101 9.34734 6.99063 7.56888 10.8658 7.43198 7.43071 6.35849 6.00424 9.76735 numMergedOcc 0
189 mol 227 unq 2 iso 3 dist 7.22101 7.56888 10.8658 9.34734 6.99063 7.43198 7.43071 6.35849 9.76735 6.00424 numMergedOcc 0
190 mol 227 unq 2 iso 4 dist 7.56888 9.34734 7.43198 7.22101 10.8658 6.99063 7.43071 9.76735 6.00424 6.35849 numMergedOcc 0
191 mol 227 unq 2 iso 5 dist 7.56888 7.22101 10.8658 9.34734 7.43198 6.99063 7.43071 9.76735 6.35849 6.00424 numMergedOcc 0
192 mol 227 unq 3 iso 0 dist 9.34734 7.22101 6.99063 7.56888 7.43198 10.8658 5.41321 10.7656 10.9607 5.10635 numMergedOcc 0
193 mol 227 unq 3 iso 1 dist 9.34734 7.56888 7.43198 7.22101 6.99063 10.8658 5.41321 10.7656 5.10635 10.9607 numMergedOcc 0
194 mol 227 unq 3 iso 2 dist 7.22101 9.34734 6.99063 7.56888 10.8658 7.43198 5.41321 10.9607 10.7656 5.10635 numMergedOcc 0
195 mol 227 unq 3 iso 3 dist 7.22101 7.56888 10.8658 9.34734 6.99063 7.43198 5.41321 10.9607 5.10635 10.7656 numMergedOcc 0
196 mol 227 unq 3 iso 4 dist 7.56888 9.34734 7.43198 7.22101 10.8658 6.99063 5.41321 5.10635 10.7656 10.9607 numMergedOcc 0
197 mol 227 unq 3 iso 5 dist 7.56888 7.22101 10.8658 9.34734 7.43198 6.99063 5.41321 5.10635 10.9607 10.7656 numMergedOcc 0
198 mol 227 unq 4 iso 0 dist 9.34734 7.22101 6.99063 7.55216 9.51866 12.4689 7.43071 6.00424 6.35849 9.32448 numMergedOcc 0
199 mol 227 unq 4 iso 1 dist 9.34734 7.55216 9.51866 7.22101 6.99063 12.4689 7.43071 6.00424 9.32448 6.35849 numMergedOcc 0
200 mol 227 unq 4 iso 2 dist 7.22101 9.34734 6.99063 7.55216 12.4689 9.51866 7.43071 6.35849 6.00424 9.32448 numMergedOcc 0
201 mol 227 unq 4 iso 3 dist 7.22101 7.55216 12.4689 9.34734 6.99063 9.51866 7.43071 6.35849 9.32448 6.00424 numMergedOcc 0
202 mol 227 unq 4 iso 4 dist 7.55216 9.34734 9.51866 7.22101 12.4689 6.99063 7.43071 9.32448 6.00424 6.35849 numMergedOcc 0
203 mol 227 unq 4 iso 5 dist 7.55216 7.22101 12.4689 9.34734 9.51866 6.99063 7.43071 9.32448 6.35849 6.00424 numMergedOcc 0
204 mol 227 unq 5 iso 0 dist 9.34734 7.22101 6.99063 7.55216 9.51866 12.4689 5.41321 10.7656 10.9607 6.48027 numMergedOcc 0
205 mol 227 unq 5 iso 1 dist 9.34734 7.55216 9.51866 7.22101 6.99063 12.4689 5.41321 10.7656 6.48027 10.9607 numMergedOcc 0
206 mol 227 unq 5 iso 2 dist 7.22101 9.34734 6.99063 7.55216 12.4689 9.51866 5.41321 10.9607 10.7656 6.48027 numMergedOcc 0
207 mol 227 unq 5 iso 3 dist 7.22101 7.55216 12.4689 9.34734 6.99063 9.51866 5.41321 10.9607 6.48027 10.7656 numMergedOcc 0
208 mol 227 unq 5 iso 4 dist 7.55216 9.34734 9.51866 7.22101 12.4689 6.99063 5.41321 6.48027 10.7656 10.9607 numMergedOcc 0
209 mol 227 unq 5 iso 5 dist 7.55216 7.22101 12.4689 9.34734 9.51866 6.99063 5.41321 6.48027 10.9607 10.7656 numMergedOcc 0
210 mol 227 unq 2 iso 0 dist 9.34734 8.65997 7.60506 7.56888 7.43198 9.70012 7.43071 6.00424 10.204 9.76735 numMergedOcc 0
211 mol 227 unq 2 iso 1 dist 9.34734 7.56888 7.43198 8.65997 7.60506 9.70012 7.43071 6.00424 9.76735 10.204 numMergedOcc 0
212 mol 227 unq 2 iso 2 dist 8.65997 9.34734 7.60506 7.56888 9.70012 7.43198 7.43071 10.204 6.00424 9.76735 numMergedOcc 0
213 mol 227 unq 2 iso 3 dist 8.65997 7.56888 9.70012 9.34734 7.60506 7.43198 7.43071 10.204 9.76735 6.00424 numMergedOcc 0
214 mol 227 unq 2 iso 4 dist 7.56888 9.34734 7.43198 8.65997 9.70012 7.60506 7.43071 9.76735 6.00424 10.204 numMergedOcc 0
215 mol 227 unq 2 iso 5 dist 7.56888 8.65997 9.70012 9.34734 7.43198 7.60506 7.43071 9.76735 10.204 6.00424 numMergedOcc 0
216 mol 227 unq 3 iso 0 dist 9.34734 8.65997 7.60506 7.56888 7.43198 9.70012 5.41321 10.7656 9.72615 5.10635 numMergedOcc 0
217 mol 227 unq 3 iso 1 dist 9.34734 7.56888 7.43198 8.65997 7.60506 9.70012 5.41321 10.7656 5.10635 9.72615 numMergedOcc 0
218 mol 227 unq 3 iso 2 dist 8.65997 9.34734 7.60506 7.56888 9.70012 7.43198 5.41321 9.72615 10.7656 5.10635 numMergedOcc 0
219 mol 227 unq 3 iso 3 dist 8.65997 7.56888 9.70012 9.34734 7.60506 7.43198 5.41321 9.72615 5.10635 10.7656 numMergedOcc 0
220 mol 227 unq 3 iso 4 dist 7.56888 9.34734 7.43198 8.65997 9.70012 7.60506 5.41321 5.10635 10.7656 9.72615 numMergedOcc 0
221 mol 227 unq 3 iso 5 dist 7.56888 8.65997 9.70012 9.34734 7.43198 7.60506 5.41321 5.10635 9.72615 10.7656 numMergedOcc 0
222 mol 227 unq 4 iso 0 dist 9.34734 8.65997 7.60506 7.55216 9.51866 12.9332 7.43071 6.00424 10.204 9.32448 numMergedOcc 0
223 mol 227 unq 4 iso 1 dist 9.34734 7.55216 9.51866 8.65997 7.60506 12.9332 7.43071 6.00424 9.32448 10.204 numMergedOcc 0
224 mol 227 unq 4 iso 2 dist 8.65997 9.34734 7.60506 7.55216 12.9332 9.51866 7.43071 10.204 6.00424 9.32448 numMergedOcc 0
225 mol 227 unq 4 iso 3 dist 8.65997 7.55216 12.9332 9.34734 7.60506 9.51866 7.43071 10.204 9.32448 6.00424 numMergedOcc 0
226 mol 227 unq 4 iso 4 dist 7.55216 9.34734 9.51866 8.65997 12.9332 7.60506 7.43071 9.32448 6.00424 10.204 numMergedOcc 0
227 mol 227 unq 4 iso 5 dist 7.55216 8.65997 12.9332 9.34734 9.51866 7.60506 7.43071 9.32448 10.204 6.00424 numMergedOcc 0
228 mol 227 unq 5 iso 0 dist 9.34734 8.65997 7.60506 7.55216 9.51866 12.9332 5.41321 10.7656 9.72615 6.48027 numMergedOcc 0
229 mol 227 unq 5 iso 1 dist 9.34734 7.55216 9.51866 8.65997 7.60506 12.9332 5.41321 10.7656 6.48027 9.72615 numMergedOcc 0
230 mol 227 unq 5 iso 2 dist 8.65997 9.34734 7.60506 7.55216 12.9332 9.51866 5.41321 9.72615 10.7656 6.48027 numMergedOcc 0
231 mol 227 unq 5 iso 3 dist 8.65997 7.55216 12.9332 9.34734 7.60506 9.51866 5.41321 9.72615 6.48027 10.7656 numMergedOcc 0
232 mol 227 unq 5 iso 4 dist 7.55216 9.34734 9.51866 8.65997 12.9332 7.60506 5.41321 6.48027 10.7656 9.72615 numMergedOcc 0
233 mol 227 unq 5 iso 5 dist 7.55216 8.65997 12.9332 9.34734 9.51866 7.60506 5.41321 6.48027 9.72615 10.7656 numMergedOcc 0
234 mol 227 unq 4 iso 0 dist 9.34734 7.56888 7.43198 7.55216 9.51866 4.48529 7.43071 6.00424 9.76735 9.32448 numMergedOcc 0
235 mol 227 unq 4 iso 1 dist 9.34734 7.55216 9.51866 7.56888 7.43198 4.48529 7.43071 6.00424 9.32448 9.76735 numMergedOcc 0
236 mol 227 unq 4 iso 2 dist 7.56888 9.34734 7.43198 7.55216 4.48529 9.51866 7.43071 9.76735 6.00424 9.32448 numMergedOcc 0
237 mol 227 unq 4 iso 3 dist 7.56888 7.55216 4.48529 9.34734 7.43198 9.51866 7.43071 9.76735 9.32448 6.00424 numMergedOcc 0
238 mol 227 unq 4 iso 4 dist 7.55216 9.34734 9.51866 7.56888 4.48529 7.43198 7.43071 9.32448 6.00424 9.76735 numMergedOcc 0
239 mol 227 unq 4 iso 5 dist 7.55216 7.56888 4.48529 9.34734 9.51866 7.43198 7.43071 9.32448 9.76735 6.00424 numMergedOcc 0
240 mol 227 unq 5 iso 0 dist 9.34734 7.56888 7.43198 7.55216 9.51866 4.48529 5.41321 10.7656 5.10635 6.48027 numMergedOcc 0
241 mol 227 unq 5 iso 1 dist 9.34734 7.55216 9.51866 7.56888 7.43198 4.48529 5.41321 10.7656 6.48027 5.10635 numMergedOcc 0
242 mol 227 unq 5 iso 2 dist 7.56888 9.34734 7.43198 7.55216 4.48529 9.51866 5.41321 5.10635 10.7656 6.48027 numMergedOcc 0
243 mol 227 unq 5 iso 3 dist 7.56888 7.55216 4.48529 9.34734 7.43198 9.51866 5.41321 5.10635 6.48027 10.7656 numMergedOcc 0
244 mol 227 unq 5 iso 4 dist 7.55216 9.34734 9.51866 7.56888 4.48529 7.43198 5.41321 6.48027 10.7656 5.10635 numMergedOcc 0
245 mol 227 unq 5 iso 5 dist 7.55216 7.56888 4.48529 9.34734 9.51866 7.43198 5.41321 6.48027 5.10635 10.7656 numMergedOcc 0
246 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 numMergedOcc 0
247 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 numMergedOcc 0
248 mol 227 unq 2 iso 2 dist 8.65997 7.22101 5.22356 7.56888 9.70012 10.8658 7.43071 10.204 6.35849 9.76735 numMergedOcc 0
249 mol 227 unq 2 iso 3 dist 8.65997 7.56888 9.70012 7.22101 5.22356 10.8658 7.43071 10.204 9.76735 6.35849 numMergedOcc 0
250 mol 227 unq 2 iso 4 dist 7.56888 7.22101 10.8658 8.65997 9.70012 5.22356 7.43071 9.76735 6.35849 10.204 numMergedOcc 0
251 mol 227 unq 2 iso 5 dist 7.56888 8.65997 9.70012 7.22101 10.8658 5.22356 7.43071 9.76735 10.204 6.35849 numMergedOcc 0
252 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 numMergedOcc 0
253 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 numMergedOcc 0
254 mol 227 unq 3 iso 2 dist 8.65997 7.22101 5.22356 7.56888 9.70012 10.8658 5.41321 9.72615 10.9607 5.10635 numMergedOcc 0
255 mol 227 unq 3 iso 3 dist 8.65997 7.56888 9.70012 7.22101 5.22356 10.8658 5.41321 9.72615 5.10635 10.9607 numMergedOcc 0
256 mol 227 unq 3 iso 4 dist 7.56888 7.22101 10.8658 8.65997 9.70012 5.22356 5.41321 5.10635 10.9607 9.72615 numMergedOcc 0
257 mol 227 unq 3 iso 5 dist 7.56888 8.65997 9.70012 7.22101 10.8658 5.22356 5.41321 5.10635 9.72615 10.9607 numMergedOcc 0
258 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 numMergedOcc 0
259 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 numMergedOcc 0
260 mol 227 unq 4 iso 2 dist 8.65997 7.22101 5.22356 7.55216 12.9332 12.4689 7.43071 10.204 6.35849 9.32448 numMergedOcc 0
261 mol 227 unq 4 iso 3 dist 8.65997 7.55216 12.9332 7.22101 5.22356 12.4689 7.43071 10.204 9.32448 6.35849 numMergedOcc 0
262 mol 227 unq 4 iso 4 dist 7.55216 7.22101 12.4689 8.65997 12.9332 5.22356 7.43071 9.32448 6.35849 10.204 numMergedOcc 0
263 mol 227 unq 4 iso 5 dist 7.55216 8.65997 12.9332 7.22101 12.4689 5.22356 7.43071 9.32448 10.204 6.35849 numMergedOcc 0
264 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 numMergedOcc 0
265 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 numMergedOcc 0
266 mol 227 unq 5 iso 2 dist 8.65997 7.22101 5.22356 7.55216 12.9332 12.4689 5.41321 9.72615 10.9607 6.48027 numMergedOcc 0
267 mol 227 unq 5 iso 3 dist 8.65997 7.55216 12.9332 7.22101 5.22356 12.4689 5.41321 9.72615 6.48027 10.9607 numMergedOcc 0
268 mol 227 unq 5 iso 4 dist 7.55216 7.22101 12.4689 8.65997 12.9332 5.22356 5.41321 6.48027 10.9607 9.72615 numMergedOcc 0
269 mol 227 unq 5 iso 5 dist 7.55216 8.65997 12.9332 7.22101 12.4689 5.22356 5.41321 6.48027 9.72615 10.9607 numMergedOcc 0
270 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 numMergedOcc 0
271 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 numMergedOcc 0
272 mol 227 unq 4 iso 2 dist 7.56888 7.22101 10.8658 7.55216 4.48529 12.4689 7.43071 9.76735 6.35849 9.32448 numMergedOcc 0
273 mol 227 unq 4 iso 3 dist 7.56888 7.55216 4.48529 7.22101 10.8658 12.4689 7.43071 9.76735 9.32448 6.35849 numMergedOcc 0
274 mol 227 unq 4 iso 4 dist 7.55216 7.22101 12.4689 7.56888 4.48529 10.8658 7.43071 9.32448 6.35849 9.76735 numMergedOcc 0
275 mol 227 unq 4 iso 5 dist 7.55216 7.56888 4.48529 7.22101 12.4689 10.8658 7.43071 9.32448 9.76735 6.35849 numMergedOcc 0
276 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 numMergedOcc 0
277 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 numMergedOcc 0
278 mol 227 unq 5 iso 2 dist 7.56888 7.22101 10.8658 7.55216 4.48529 12.4689 5.41321 5.10635 10.9607 6.48027 numMergedOcc 0
279 mol 227 unq 5 iso 3 dist 7.56888 7.55216 4.48529 7.22101 10.8658 12.4689 5.41321 5.10635 6.48027 10.9607 numMergedOcc 0
280 mol 227 unq 5 iso 4 dist 7.55216 7.22101 12.4689 7.56888 4.48529 10.8658 5.41321 6.48027 10.9607 5.10635 numMergedOcc 0
281 mol 227 unq 5 iso 5 dist 7.55216 7.56888 4.48529 7.22101 12.4689 10.8658 5.41321 6.48027 5.10635 10.9607 numMergedOcc 0
282 mol 227 unq 4 iso 0 dist 8.65997 7.56888 9.70012 7.55216 12.9332 4.48529 7.43071 10.204 9.76735 9.32448 numMergedOcc 0
283 mol 227 unq 4 iso 1 dist 8.65997 7.55216 12.9332 7.56888 9.70012 4.48529 7.43071 10.204 9.32448 9.76735 numMergedOcc 0
284 mol 227 unq 4 iso 2 dist 7.56888 8.65997 9.70012 7.55216 4.48529 12.9332 7.43071 9.76735 10.204 9.32448 numMergedOcc 0
285 mol 227 unq 4 iso 3 dist 7.56888 7.55216 4.48529 8.65997 9.70012 12.9332 7.43071 9.76735 9.32448 10.204 numMergedOcc 0
286 mol 227 unq 4 iso 4 dist 7.55216 8.65997 12.9332 7.56888 4.48529 9.70012 7.43071 9.32448 10.204 9.76735 numMergedOcc 0
287 mol 227 unq 4 iso 5 dist 7.55216 7.56888 4.48529 8.65997 12.9332 9.70012 7.43071 9.32448 9.76735 10.204 numMergedOcc 0
288 mol 227 unq 5 iso 0 dist 8.65997 7.56888 9.70012 7.55216 12.9332 4.48529 5.41321 9.72615 5.10635 6.48027 numMergedOcc 0
289 mol 227 unq 5 iso 1 dist 8.65997 7.55216 12.9332 7.56888 9.70012 4.48529 5.41321 9.72615 6.48027 5.10635 numMergedOcc 0
290 mol 227 unq 5 iso 2 dist 7.56888 8.65997 9.70012 7.55216 4.48529 12.9332 5.41321 5.10635 9.72615 6.48027 numMergedOcc 0
291 mol 227 unq 5 iso 3 dist 7.56888 7.55216 4.48529 8.65997 9.70012 12.9332 5.41321 5.10635 6.48027 9.72615 numMergedOcc 0
292 mol 227 unq 5 iso 4 dist 7.55216 8.65997 12.9332 7.56888 4.48529 9.70012 5.41321 6.48027 9.72615 5.10635 numMergedOcc 0
293 mol 227 unq 5 iso 5 dist 7.55216 7.56888 4.48529 8.65997 12.9332 9.70012 5.41321 6.48027 5.10635 9.72615 numMergedOcc 0
294 mol 234 unq 0 iso 0 dist 8.34494 6.56247 6.29886 9.36357 12.1694 7.82322 9.81425 4.3717 4.46561 10.641 numMergedOcc 0
295 mol 234 unq 0 iso 1 dist 8.34494 9.36357 12.1694 6.56247 6.29886 7.82322 9.81425 4.3717 10.641 4.46561 numMergedOcc 0
296 mol 234 unq 0 iso 2 dist 6.56247 8.34494 6.29886 9.36357 7.82322 12.1694 9.81425 4.46561 4.3717 10.641 numMergedOcc 0
297 mol 234 unq 0 iso 3 dist 6.56247 9.36357 7.82322 8.34494 6.29886 12.1694 9.81425 4.46561 10.641 4.3717 numMergedOcc 0
298 mol 234 unq 0 iso 4 dist 9.36357 8.34494 12.1694 6.56247 7.82322 6.29886 9.81425 10.641 4.3717 4.46561 numMergedOcc 0
299 mol 234 unq 0 iso 5 dist 9.36357 6.56247 7.82322 8.34494 12.1694 6.29886 9.81425 10.641 4.46561 4.3717 numMergedOcc 0
300 mol 261 unq 0 iso 0 dist 8.02547 8.43057 10.0727 6.05727 5.51688 4.63549 8.43974 5.91643 8.29908 5.02383 numMergedOcc 0
301 mol 261 unq 0 iso 1 dist 8.02547 6.05727 5.51688 8.43057 10.0727 4.63549 8.43974 5.91643 5.02383 8.29908 numMergedOcc 0
302 mol 261 unq 0 iso 2 dist 8.43057 8.02547 10.0727 6.05727 4.63549 5.51688 8.43974 8.29908 5.91643 5.02383 numMergedOcc 0
303 mol 261 unq 0 iso 3 dist 8.43057 6.05727 4.63549 8.02547 10.0727 5.51688 8.43974 8.29908 5.02383 5.91643 numMergedOcc 0
304 mol 261 unq 0 iso 4 dist 6.05727 8.02547 5.51688 8.43057 4.63549 10.0727 8.43974 5.02383 5.91643 8.29908 numMergedOcc 0
305 mol 261 unq 0 iso 5 dist 6.05727 8.43057 4.63549 8.02547 5.51688 10.0727 8.43974 5.02383 8.29908 5.91643 numMergedOcc 0
306 mol 282 unq 0 iso 0 dist 8.04483 8.76532 10.0156 6.33524 5.39891 4.66602 9.0975 5.65568 8.12478 5.0324 numMergedOcc 0
307 mol 282 unq 0 iso 1 dist 8.04483 6.33524 5.39891 8.76532 10.0156 4.66602 9.0975 5.65568 5.0324 8.12478 numMergedOcc 0
308 mol 282 unq 0 iso 2 dist 8.76532 8.04483 10.0156 6.33524 4.66602 5.39891 9.0975 8.12478 5.65568 5.0324 numMergedOcc 0
309 mol 282 unq 0 iso 3 dist 8.76532 6.33524 4.66602 8.04483 10.0156 5.39891 9.0975 8.12478 5.0324 5.65568 numMergedOcc 0
310 mol 282 unq 0 iso 4 dist 6.33524 8.04483 5.39891 8.76532 4.66602 10.0156 9.0975 5.0324 5.65568 8.12478 numMergedOcc 0
311 mol 282 unq 0 iso 5 dist 6.33524 8.76532 4.66602 8.04483 5.39891 10.0156 9.0975 5.0324 8.12478 5.65568 numMergedOcc 0
