0 mol 8 unq 0 iso 0 dist 9.95165 15.9496 6.82379 14.678 6.24978 6.94408 17.3707 9.66439 11.2508 5.3787 numMergedOcc 0
1 mol 8 unq 0 iso 1 dist 9.95165 15.9496 6.82379 17.3707 9.66439 11.2508 14.678 6.24978 6.94408 5.3787 numMergedOcc 0
2 mol 8 unq 0 iso 2 dist 9.95165 14.678 6.24978 15.9496 6.82379 6.94408 17.3707 9.66439 5.3787 11.2508 numMergedOcc 0
3 mol 8 unq 0 iso 3 dist 9.95165 14.678 6.24978 17.3707 9.66439 5.3787 15.9496 6.82379 6.94408 11.2508 numMergedOcc 0
4 mol 8 unq 0 iso 4 dist 9.95165 17.3707 9.66439 15.9496 6.82379 11.2508 14.678 6.24978 5.3787 6.94408 numMergedOcc 0
5 mol 8 unq 0 iso 5 dist 9.95165 17.3707 9.66439 14.678 6.24978 5.3787 15.9496 6.82379 11.2508 6.94408 numMergedOcc 0
6 mol 8 unq 1 iso 0 dist 9.95165 15.9496 6.82379 14.678 6.24978 6.94408 12.915 7.3915 12.4076 9.22548 numMergedOcc 0
7 mol 8 unq 1 iso 1 dist 9.95165 15.9496 6.82379 12.915 7.3915 12.4076 14.678 6.24978 6.94408 9.22548 numMergedOcc 0
8 mol 8 unq 1 iso 2 dist 9.95165 14.678 6.24978 15.9496 6.82379 6.94408 12.915 7.3915 9.22548 12.4076 numMergedOcc 0
9 mol 8 unq 1 iso 3 dist 9.95165 14.678 6.24978 12.915 7.3915 9.22548 15.9496 6.82379 6.94408 12.4076 numMergedOcc 0
10 mol 8 unq 1 iso 4 dist 9.95165 12.915 7.3915 15.9496 6.82379 12.4076 14.678 6.24978 9.22548 6.94408 numMergedOcc 0
11 mol 8 unq 1 iso 5 dist 9.95165 12.915 7.3915 14.678 6.24978 9.22548 15.9496 6.82379 12.4076 6.94408 numMergedOcc 0
12 mol 8 unq 1 iso 0 dist 9.95165 15.9496 6.82379 17.3707 9.66439 11.2508 12.915 7.3915 12.4076 7.96511 numMergedOcc 0
13 mol 8 unq 1 iso 1 dist 9.95165 15.9496 6.82379 12.915 7.3915 12.4076 17.3707 9.66439 11.2508 7.96511 numMergedOcc 0
14 mol 8 unq 1 iso 2 dist 9.95165 17.3707 9.66439 15.9496 6.82379 11.2508 12.915 7.3915 7.96511 12.4076 numMergedOcc 0
15 mol 8 unq 1 iso 3 dist 9.95165 17.3707 9.66439 12.915 7.3915 7.96511 15.9496 6.82379 11.2508 12.4076 numMergedOcc 0
16 mol 8 unq 1 iso 4 dist 9.95165 12.915 7.3915 15.9496 6.82379 12.4076 17.3707 9.66439 7.96511 11.2508 numMergedOcc 0
17 mol 8 unq 1 iso 5 dist 9.95165 12.915 7.3915 17.3707 9.66439 7.96511 15.9496 6.82379 12.4076 11.2508 numMergedOcc 0
18 mol 8 unq 1 iso 0 dist 9.95165 14.678 6.24978 17.3707 9.66439 5.3787 12.915 7.3915 9.22548 7.96511 numMergedOcc 0
19 mol 8 unq 1 iso 1 dist 9.95165 14.678 6.24978 12.915 7.3915 9.22548 17.3707 9.66439 5.3787 7.96511 numMergedOcc 0
20 mol 8 unq 1 iso 2 dist 9.95165 17.3707 9.66439 14.678 6.24978 5.3787 12.915 7.3915 7.96511 9.22548 numMergedOcc 0
21 mol 8 unq 1 iso 3 dist 9.95165 17.3707 9.66439 12.915 7.3915 7.96511 14.678 6.24978 5.3787 9.22548 numMergedOcc 0
22 mol 8 unq 1 iso 4 dist 9.95165 12.915 7.3915 14.678 6.24978 9.22548 17.3707 9.66439 7.96511 5.3787 numMergedOcc 0
23 mol 8 unq 1 iso 5 dist 9.95165 12.915 7.3915 17.3707 9.66439 7.96511 14.678 6.24978 9.22548 5.3787 numMergedOcc 0
24 mol 19 unq 0 iso 0 dist 9.23617 11.8354 7.48847 14.4019 6.92532 10.8007 10.38 6.36455 10.6598 5.03957 numMergedOcc 0
25 mol 19 unq 0 iso 1 dist 9.23617 11.8354 7.48847 10.38 6.36455 10.6598 14.4019 6.92532 10.8007 5.03957 numMergedOcc 0
26 mol 19 unq 0 iso 2 dist 9.23617 14.4019 6.92532 11.8354 7.48847 10.8007 10.38 6.36455 5.03957 10.6598 numMergedOcc 0
27 mol 19 unq 0 iso 3 dist 9.23617 14.4019 6.92532 10.38 6.36455 5.03957 11.8354 7.48847 10.8007 10.6598 numMergedOcc 0
28 mol 19 unq 0 iso 4 dist 9.23617 10.38 6.36455 11.8354 7.48847 10.6598 14.4019 6.92532 5.03957 10.8007 numMergedOcc 0
29 mol 19 unq 0 iso 5 dist 9.23617 10.38 6.36455 14.4019 6.92532 5.03957 11.8354 7.48847 10.6598 10.8007 numMergedOcc 0
30 mol 19 unq 1 iso 0 dist 8.59114 5.67097 7.48847 14.3476 6.92532 10.8007 12.7 6.36455 10.6598 5.03957 numMergedOcc 0
31 mol 19 unq 1 iso 1 dist 8.59114 5.67097 7.48847 12.7 6.36455 10.6598 14.3476 6.92532 10.8007 5.03957 numMergedOcc 0
32 mol 19 unq 1 iso 2 dist 8.59114 14.3476 6.92532 5.67097 7.48847 10.8007 12.7 6.36455 5.03957 10.6598 numMergedOcc 0
33 mol 19 unq 1 iso 3 dist 8.59114 14.3476 6.92532 12.7 6.36455 5.03957 5.67097 7.48847 10.8007 10.6598 numMergedOcc 0
34 mol 19 unq 1 iso 4 dist 8.59114 12.7 6.36455 5.67097 7.48847 10.6598 14.3476 6.92532 5.03957 10.8007 numMergedOcc 0
35 mol 19 unq 1 iso 5 dist 8.59114 12.7 6.36455 14.3476 6.92532 5.03957 5.67097 7.48847 10.6598 10.8007 numMergedOcc 0
36 mol 19 unq 2 iso 0 dist 8.63204 15.2051 7.48847 6.57145 6.92532 10.8007 6.01189 6.36455 10.6598 5.03957 numMergedOcc 0
37 mol 19 unq 2 iso 1 dist 8.63204 15.2051 7.48847 6.01189 6.36455 10.6598 6.57145 6.92532 10.8007 5.03957 numMergedOcc 0
38 mol 19 unq 2 iso 2 dist 8.63204 6.57145 6.92532 15.2051 7.48847 10.8007 6.01189 6.36455 5.03957 10.6598 numMergedOcc 0
39 mol 19 unq 2 iso 3 dist 8.63204 6.57145 6.92532 6.01189 6.36455 5.03957 15.2051 7.48847 10.8007 10.6598 numMergedOcc 0
40 mol 19 unq 2 iso 4 dist 8.63204 6.01189 6.36455 15.2051 7.48847 10.6598 6.57145 6.92532 5.03957 10.8007 numMergedOcc 0
41 mol 19 unq 2 iso 5 dist 8.63204 6.01189 6.36455 6.57145 6.92532 5.03957 15.2051 7.48847 10.6598 10.8007 numMergedOcc 0
42 mol 60 unq 0 iso 0 dist 7.4674 12.6215 9.96399 12.7297 7.55695 7.29309 14.5723 8.82176 12.2509 5.00018 numMergedOcc 0
43 mol 60 unq 0 iso 1 dist 7.4674 12.6215 9.96399 14.5723 8.82176 12.2509 12.7297 7.55695 7.29309 5.00018 numMergedOcc 0
44 mol 60 unq 0 iso 2 dist 7.4674 12.7297 7.55695 12.6215 9.96399 7.29309 14.5723 8.82176 5.00018 12.2509 numMergedOcc 0
45 mol 60 unq 0 iso 3 dist 7.4674 12.7297 7.55695 14.5723 8.82176 5.00018 12.6215 9.96399 7.29309 12.2509 numMergedOcc 0
46 mol 60 unq 0 iso 4 dist 7.4674 14.5723 8.82176 12.6215 9.96399 12.2509 12.7297 7.55695 5.00018 7.29309 numMergedOcc 0
47 mol 60 unq 0 iso 5 dist 7.4674 14.5723 8.82176 12.7297 7.55695 5.00018 12.6215 9.96399 12.2509 7.29309 numMergedOcc 0
48 mol 60 unq 1 iso 0 dist 8.4928 5.09908 9.96399 10.0675 7.55695 7.29309 14.3334 8.82176 12.2509 5.00018 numMergedOcc 0
49 mol 60 unq 1 iso 1 dist 8.4928 5.09908 9.96399 14.3334 8.82176 12.2509 10.0675 7.55695 7.29309 5.00018 numMergedOcc 0
50 mol 60 unq 1 iso 2 dist 8.4928 10.0675 7.55695 5.09908 9.96399 7.29309 14.3334 8.82176 5.00018 12.2509 numMergedOcc 0
51 mol 60 unq 1 iso 3 dist 8.4928 10.0675 7.55695 14.3334 8.82176 5.00018 5.09908 9.96399 7.29309 12.2509 numMergedOcc 0
52 mol 60 unq 1 iso 4 dist 8.4928 14.3334 8.82176 5.09908 9.96399 12.2509 10.0675 7.55695 5.00018 7.29309 numMergedOcc 0
53 mol 60 unq 1 iso 5 dist 8.4928 14.3334 8.82176 10.0675 7.55695 5.00018 5.09908 9.96399 12.2509 7.29309 numMergedOcc 0
54 mol 65 unq 0 iso 0 dist 5.12044 5.05869 5.69971 6.13504 9.83239 9.20128 5.38234 8.37515 10.2941 8.06868 numMergedOcc 0
55 mol 65 unq 0 iso 1 dist 5.12044 5.05869 5.69971 5.38234 8.37515 10.2941 6.13504 9.83239 9.20128 8.06868 numMergedOcc 0
56 mol 65 unq 0 iso 2 dist 5.12044 6.13504 9.83239 5.05869 5.69971 9.20128 5.38234 8.37515 8.06868 10.2941 numMergedOcc 0
57 mol 65 unq 0 iso 3 dist 5.12044 6.13504 9.83239 5.38234 8.37515 8.06868 5.05869 5.69971 9.20128 10.2941 numMergedOcc 0
58 mol 65 unq 0 iso 4 dist 5.12044 5.38234 8.37515 5.05869 5.69971 10.2941 6.13504 9.83239 8.06868 9.20128 numMergedOcc 0
59 mol 65 unq 0 iso 5 dist 5.12044 5.38234 8.37515 6.13504 9.83239 8.06868 5.05869 5.69971 10.2941 9.20128 numMergedOcc 0
60 mol 112 unq 0 iso 0 dist 7.35503 10.0299 7.23962 9.13496 9.00067 7.03147 10.1793 9.89499 11.4954 5.54347 numMergedOcc 0
61 mol 112 unq 0 iso 1 dist 7.35503 10.0299 7.23962 10.1793 9.89499 11.4954 9.13496 9.00067 7.03147 5.54347 numMergedOcc 0
62 mol 112 unq 0 iso 2 dist 7.35503 9.13496 9.00067 10.0299 7.23962 7.03147 10.1793 9.89499 5.54347 11.4954 numMergedOcc 0
63 mol 112 unq 0 iso 3 dist 7.35503 9.13496 9.00067 10.1793 9.89499 5.54347 10.0299 7.23962 7.03147 11.4954 numMergedOcc 0
64 mol 112 unq 0 iso 4 dist 7.35503 10.1793 9.89499 10.0299 7.23962 11.4954 9.13496 9.00067 5.54347 7.03147 numMergedOcc 0
65 mol 112 unq 0 iso 5 dist 7.35503 10.1793 9.89499 9.13496 9.00067 5.54347 10.0299 7.23962 11.4954 7.03147 numMergedOcc 0
66 mol 112 unq 1 iso 0 dist 7.35503 10.0299 7.23962 9.13496 9.00067 7.03147 11.5698 7.30204 7.05226 5.56241 numMergedOcc 0
67 mol 112 unq 1 iso 1 dist 7.35503 10.0299 7.23962 11.5698 7.30204 7.05226 9.13496 9.00067 7.03147 5.56241 numMergedOcc 0
68 mol 112 unq 1 iso 2 dist 7.35503 9.13496 9.00067 10.0299 7.23962 7.03147 11.5698 7.30204 5.56241 7.05226 numMergedOcc 0
69 mol 112 unq 1 iso 3 dist 7.35503 9.13496 9.00067 11.5698 7.30204 5.56241 10.0299 7.23962 7.03147 7.05226 numMergedOcc 0
70 mol 112 unq 1 iso 4 dist 7.35503 11.5698 7.30204 10.0299 7.23962 7.05226 9.13496 9.00067 5.56241 7.03147 numMergedOcc 0
71 mol 112 unq 1 iso 5 dist 7.35503 11.5698 7.30204 9.13496 9.00067 5.56241 10.0299 7.23962 7.05226 7.03147 numMergedOcc 0
72 mol 112 unq 1 iso 0 dist 7.35503 10.0299 7.23962 10.1793 9.89499 11.4954 11.5698 7.30204 7.05226 6.77737 numMergedOcc 0
73 mol 112 unq 1 iso 1 dist 7.35503 10.0299 7.23962 11.5698 7.30204 7.05226 10.1793 9.89499 11.4954 6.77737 numMergedOcc 0
74 mol 112 unq 1 iso 2 dist 7.35503 10.1793 9.89499 10.0299 7.23962 11.4954 11.5698 7.30204 6.77737 7.05226 numMergedOcc 0
75 mol 112 unq 1 iso 3 dist 7.35503 10.1793 9.89499 11.5698 7.30204 6.77737 10.0299 7.23962 11.4954 7.05226 numMergedOcc 0
76 mol 112 unq 1 iso 4 dist 7.35503 11.5698 7.30204 10.0299 7.23962 7.05226 10.1793 9.89499 6.77737 11.4954 numMergedOcc 0
77 mol 112 unq 1 iso 5 dist 7.35503 11.5698 7.30204 10.1793 9.89499 6.77737 10.0299 7.23962 7.05226 11.4954 numMergedOcc 0
78 mol 112 unq 1 iso 0 dist 7.35503 9.13496 9.00067 10.1793 9.89499 5.54347 11.5698 7.30204 5.56241 6.77737 numMergedOcc 0
79 mol 112 unq 1 iso 1 dist 7.35503 9.13496 9.00067 11.5698 7.30204 5.56241 10.1793 9.89499 5.54347 6.77737 numMergedOcc 0
80 mol 112 unq 1 iso 2 dist 7.35503 10.1793 9.89499 9.13496 9.00067 5.54347 11.5698 7.30204 6.77737 5.56241 numMergedOcc 0
81 mol 112 unq 1 iso 3 dist 7.35503 10.1793 9.89499 11.5698 7.30204 6.77737 9.13496 9.00067 5.54347 5.56241 numMergedOcc 0
82 mol 112 unq 1 iso 4 dist 7.35503 11.5698 7.30204 9.13496 9.00067 5.56241 10.1793 9.89499 6.77737 5.54347 numMergedOcc 0
83 mol 112 unq 1 iso 5 dist 7.35503 11.5698 7.30204 10.1793 9.89499 6.77737 9.13496 9.00067 5.56241 5.54347 numMergedOcc 0
84 mol 112 unq 2 iso 0 dist 8.79543 11.7503 7.23962 8.0952 9.00067 7.03147 7.12714 9.89499 11.4954 5.54347 numMergedOcc 0
85 mol 112 unq 2 iso 1 dist 8.79543 11.7503 7.23962 7.12714 9.89499 11.4954 8.0952 9.00067 7.03147 5.54347 numMergedOcc 0
86 mol 112 unq 2 iso 2 dist 8.79543 8.0952 9.00067 11.7503 7.23962 7.03147 7.12714 9.89499 5.54347 11.4954 numMergedOcc 0
87 mol 112 unq 2 iso 3 dist 8.79543 8.0952 9.00067 7.12714 9.89499 5.54347 11.7503 7.23962 7.03147 11.4954 numMergedOcc 0
88 mol 112 unq 2 iso 4 dist 8.79543 7.12714 9.89499 11.7503 7.23962 11.4954 8.0952 9.00067 5.54347 7.03147 numMergedOcc 0
89 mol 112 unq 2 iso 5 dist 8.79543 7.12714 9.89499 8.0952 9.00067 5.54347 11.7503 7.23962 11.4954 7.03147 numMergedOcc 0
90 mol 112 unq 3 iso 0 dist 8.79543 11.7503 7.23962 8.0952 9.00067 7.03147 10.886 7.30204 7.05226 5.56241 numMergedOcc 0
91 mol 112 unq 3 iso 1 dist 8.79543 11.7503 7.23962 10.886 7.30204 7.05226 8.0952 9.00067 7.03147 5.56241 numMergedOcc 0
92 mol 112 unq 3 iso 2 dist 8.79543 8.0952 9.00067 11.7503 7.23962 7.03147 10.886 7.30204 5.56241 7.05226 numMergedOcc 0
93 mol 112 unq 3 iso 3 dist 8.79543 8.0952 9.00067 10.886 7.30204 5.56241 11.7503 7.23962 7.03147 7.05226 numMergedOcc 0
94 mol 112 unq 3 iso 4 dist 8.79543 10.886 7.30204 11.7503 7.23962 7.05226 8.0952 9.00067 5.56241 7.03147 numMergedOcc 0
95 mol 112 unq 3 iso 5 dist 8.79543 10.886 7.30204 8.0952 9.00067 5.56241 11.7503 7.23962 7.05226 7.03147 numMergedOcc 0
96 mol 112 unq 3 iso 0 dist 8.79543 11.7503 7.23962 7.12714 9.89499 11.4954 10.886 7.30204 7.05226 6.77737 numMergedOcc 0
97 mol 112 unq 3 iso 1 dist 8.79543 11.7503 7.23962 10.886 7.30204 7.05226 7.12714 9.89499 11.4954 6.77737 numMergedOcc 0
98 mol 112 unq 3 iso 2 dist 8.79543 7.12714 9.89499 11.7503 7.23962 11.4954 10.886 7.30204 6.77737 7.05226 numMergedOcc 0
99 mol 112 unq 3 iso 3 dist 8.79543 7.12714 9.89499 10.886 7.30204 6.77737 11.7503 7.23962 11.4954 7.05226 numMergedOcc 0
100 mol 112 unq 3 iso 4 dist 8.79543 10.886 7.30204 11.7503 7.23962 7.05226 7.12714 9.89499 6.77737 11.4954 numMergedOcc 0
101 mol 112 unq 3 iso 5 dist 8.79543 10.886 7.30204 7.12714 9.89499 6.77737 11.7503 7.23962 7.05226 11.4954 numMergedOcc 0
102 mol 112 unq 3 iso 0 dist 8.79543 8.0952 9.00067 7.12714 9.89499 5.54347 10.886 7.30204 5.56241 6.77737 numMergedOcc 0
103 mol 112 unq 3 iso 1 dist 8.79543 8.0952 9.00067 10.886 7.30204 5.56241 7.12714 9.89499 5.54347 6.77737 numMergedOcc 0
104 mol 112 unq 3 iso 2 dist 8.79543 7.12714 9.89499 8.0952 9.00067 5.54347 10.886 7.30204 6.77737 5.56241 numMergedOcc 0
105 mol 112 unq 3 iso 3 dist 8.79543 7.12714 9.89499 10.886 7.30204 6.77737 8.0952 9.00067 5.54347 5.56241 numMergedOcc 0
106 mol 112 unq 3 iso 4 dist 8.79543 10.886 7.30204 8.0952 9.00067 5.56241 7.12714 9.89499 6.77737 5.54347 numMergedOcc 0
107 mol 112 unq 3 iso 5 dist 8.79543 10.886 7.30204 7.12714 9.89499 6.77737 8.0952 9.00067 5.56241 5.54347 numMergedOcc 0
108 mol 112 unq 4 iso 0 dist 6.48223 10.626 7.23962 8.19562 9.00067 7.03147 5.71097 9.89499 11.4954 5.54347 numMergedOcc 0
109 mol 112 unq 4 iso 1 dist 6.48223 10.626 7.23962 5.71097 9.89499 11.4954 8.19562 9.00067 7.03147 5.54347 numMergedOcc 0
110 mol 112 unq 4 iso 2 dist 6.48223 8.19562 9.00067 10.626 7.23962 7.03147 5.71097 9.89499 5.54347 11.4954 numMergedOcc 0
111 mol 112 unq 4 iso 3 dist 6.48223 8.19562 9.00067 5.71097 9.89499 5.54347 10.626 7.23962 7.03147 11.4954 numMergedOcc 0
112 mol 112 unq 4 iso 4 dist 6.48223 5.71097 9.89499 10.626 7.23962 11.4954 8.19562 9.00067 5.54347 7.03147 numMergedOcc 0
113 mol 112 unq 4 iso 5 dist 6.48223 5.71097 9.89499 8.19562 9.00067 5.54347 10.626 7.23962 11.4954 7.03147 numMergedOcc 0
114 mol 112 unq 5 iso 0 dist 6.48223 10.626 7.23962 8.19562 9.00067 7.03147 5.27363 7.30204 7.05226 5.56241 numMergedOcc 0
115 mol 112 unq 5 iso 1 dist 6.48223 10.626 7.23962 5.27363 7.30204 7.05226 8.19562 9.00067 7.03147 5.56241 numMergedOcc 0
116 mol 112 unq 5 iso 2 dist 6.48223 8.19562 9.00067 10.626 7.23962 7.03147 5.27363 7.30204 5.56241 7.05226 numMergedOcc 0
117 mol 112 unq 5 iso 3 dist 6.48223 8.19562 9.00067 5.27363 7.30204 5.56241 10.626 7.23962 7.03147 7.05226 numMergedOcc 0
118 mol 112 unq 5 iso 4 dist 6.48223 5.27363 7.30204 10.626 7.23962 7.05226 8.19562 9.00067 5.56241 7.03147 numMergedOcc 0
119 mol 112 unq 5 iso 5 dist 6.48223 5.27363 7.30204 8.19562 9.00067 5.56241 10.626 7.23962 7.05226 7.03147 numMergedOcc 0
120 mol 112 unq 5 iso 0 dist 6.48223 10.626 7.23962 5.71097 9.89499 11.4954 5.27363 7.30204 7.05226 6.77737 numMergedOcc 0
121 mol 112 unq 5 iso 1 dist 6.48223 10.626 7.23962 5.27363 7.30204 7.05226 5.71097 9.89499 11.4954 6.77737 numMergedOcc 0
122 mol 112 unq 5 iso 2 dist 6.48223 5.71097 9.89499 10.626 7.23962 11.4954 5.27363 7.30204 6.77737 7.05226 numMergedOcc 0
123 mol 112 unq 5 iso 3 dist 6.48223 5.71097 9.89499 5.27363 7.30204 6.77737 10.626 7.23962 11.4954 7.05226 numMergedOcc 0
124 mol 112 unq 5 iso 4 dist 6.48223 5.27363 7.30204 10.626 7.23962 7.05226 5.71097 9.89499 6.77737 11.4954 numMergedOcc 0
125 mol 112 unq 5 iso 5 dist 6.48223 5.27363 7.30204 5.71097 9.89499 6.77737 10.626 7.23962 7.05226 11.4954 numMergedOcc 0
126 mol 112 unq 5 iso 0 dist 6.48223 8.19562 9.00067 5.71097 9.89499 5.54347 5.27363 7.30204 5.56241 6.77737 numMergedOcc 0
127 mol 112 unq 5 iso 1 dist 6.48223 8.19562 9.00067 5.27363 7.30204 5.56241 5.71097 9.89499 5.54347 6.77737 numMergedOcc 0
128 mol 112 unq 5 iso 2 dist 6.48223 5.71097 9.89499 8.19562 9.00067 5.54347 5.27363 7.30204 6.77737 5.56241 numMergedOcc 0
129 mol 112 unq 5 iso 3 dist 6.48223 5.71097 9.89499 5.27363 7.30204 6.77737 8.19562 9.00067 5.54347 5.56241 numMergedOcc 0
130 mol 112 unq 5 iso 4 dist 6.48223 5.27363 7.30204 8.19562 9.00067 5.56241 5.71097 9.89499 6.77737 5.54347 numMergedOcc 0
131 mol 112 unq 5 iso 5 dist 6.48223 5.27363 7.30204 5.71097 9.89499 6.77737 8.19562 9.00067 5.56241 5.54347 numMergedOcc 0
132 mol 156 unq 0 iso 0 dist 9.17868 9.72865 9.31851 9.85133 6.2319 7.14831 15.9362 9.97732 9.98789 6.31306 numMergedOcc 0
133 mol 156 unq 0 iso 1 dist 9.17868 9.72865 9.31851 15.9362 9.97732 9.98789 9.85133 6.2319 7.14831 6.31306 numMergedOcc 0
134 mol 156 unq 0 iso 2 dist 9.17868 9.85133 6.2319 9.72865 9.31851 7.14831 15.9362 9.97732 6.31306 9.98789 numMergedOcc 0
135 mol 156 unq 0 iso 3 dist 9.17868 9.85133 6.2319 15.9362 9.97732 6.31306 9.72865 9.31851 7.14831 9.98789 numMergedOcc 0
136 mol 156 unq 0 iso 4 dist 9.17868 15.9362 9.97732 9.72865 9.31851 9.98789 9.85133 6.2319 6.31306 7.14831 numMergedOcc 0
137 mol 156 unq 0 iso 5 dist 9.17868 15.9362 9.97732 9.85133 6.2319 6.31306 9.72865 9.31851 9.98789 7.14831 numMergedOcc 0
138 mol 186 unq 0 iso 0 dist 4.97005 11.3961 9.56197 10.0248 7.24795 9.41955 9.14781 8.64409 8.04815 13.684 numMergedOcc 0
139 mol 186 unq 0 iso 1 dist 4.97005 11.3961 9.56197 9.14781 8.64409 8.04815 10.0248 7.24795 9.41955 13.684 numMergedOcc 0
140 mol 186 unq 0 iso 2 dist 4.97005 10.0248 7.24795 11.3961 9.56197 9.41955 9.14781 8.64409 13.684 8.04815 numMergedOcc 0
141 mol 186 unq 0 iso 3 dist 4.97005 10.0248 7.24795 9.14781 8.64409 13.684 11.3961 9.56197 9.41955 8.04815 numMergedOcc 0
142 mol 186 unq 0 iso 4 dist 4.97005 9.14781 8.64409 11.3961 9.56197 8.04815 10.0248 7.24795 13.684 9.41955 numMergedOcc 0
143 mol 186 unq 0 iso 5 dist 4.97005 9.14781 8.64409 10.0248 7.24795 13.684 11.3961 9.56197 8.04815 9.41955 numMergedOcc 0
144 mol 186 unq 1 iso 0 dist 4.97005 11.3961 9.56197 10.0248 7.24795 9.41955 6.69897 7.60202 5.92513 9.45987 numMergedOcc 0
145 mol 186 unq 1 iso 1 dist 4.97005 11.3961 9.56197 6.69897 7.60202 5.92513 10.0248 7.24795 9.41955 9.45987 numMergedOcc 0
146 mol 186 unq 1 iso 2 dist 4.97005 10.0248 7.24795 11.3961 9.56197 9.41955 6.69897 7.60202 9.45987 5.92513 numMergedOcc 0
147 mol 186 unq 1 iso 3 dist 4.97005 10.0248 7.24795 6.69897 7.60202 9.45987 11.3961 9.56197 9.41955 5.92513 numMergedOcc 0
148 mol 186 unq 1 iso 4 dist 4.97005 6.69897 7.60202 11.3961 9.56197 5.92513 10.0248 7.24795 9.45987 9.41955 numMergedOcc 0
149 mol 186 unq 1 iso 5 dist 4.97005 6.69897 7.60202 10.0248 7.24795 9.45987 11.3961 9.56197 5.92513 9.41955 numMergedOcc 0
150 mol 186 unq 1 iso 0 dist 4.97005 11.3961 9.56197 9.14781 8.64409 8.04815 6.69897 7.60202 5.92513 7.18269 numMergedOcc 0
151 mol 186 unq 1 iso 1 dist 4.97005 11.3961 9.56197 6.69897 7.60202 5.92513 9.14781 8.64409 8.04815 7.18269 numMergedOcc 0
152 mol 186 unq 1 iso 2 dist 4.97005 9.14781 8.64409 11.3961 9.56197 8.04815 6.69897 7.60202 7.18269 5.92513 numMergedOcc 0
153 mol 186 unq 1 iso 3 dist 4.97005 9.14781 8.64409 6.69897 7.60202 7.18269 11.3961 9.56197 8.04815 5.92513 numMergedOcc 0
154 mol 186 unq 1 iso 4 dist 4.97005 6.69897 7.60202 11.3961 9.56197 5.92513 9.14781 8.64409 7.18269 8.04815 numMergedOcc 0
155 mol 186 unq 1 iso 5 dist 4.97005 6.69897 7.60202 9.14781 8.64409 7.18269 11.3961 9.56197 5.92513 8.04815 numMergedOcc 0
156 mol 186 unq 1 iso 0 dist 4.97005 10.0248 7.24795 9.14781 8.64409 13.684 6.69897 7.60202 9.45987 7.18269 numMergedOcc 0
157 mol 186 unq 1 iso 1 dist 4.97005 10.0248 7.24795 6.69897 7.60202 9.45987 9.14781 8.64409 13.684 7.18269 numMergedOcc 0
158 mol 186 unq 1 iso 2 dist 4.97005 9.14781 8.64409 10.0248 7.24795 13.684 6.69897 7.60202 7.18269 9.45987 numMergedOcc 0
159 mol 186 unq 1 iso 3 dist 4.97005 9.14781 8.64409 6.69897 7.60202 7.18269 10.0248 7.24795 13.684 9.45987 numMergedOcc 0
160 mol 186 unq 1 iso 4 dist 4.97005 6.69897 7.60202 10.0248 7.24795 9.45987 9.14781 8.64409 7.18269 13.684 numMergedOcc 0
161 mol 186 unq 1 iso 5 dist 4.97005 6.69897 7.60202 9.14781 8.64409 7.18269 10.0248 7.24795 9.45987 13.684 numMergedOcc 0
162 mol 194 unq 0 iso 0 dist 8.63008 13.445 6.26839 15.3582 8.12346 8.0179 10.977 8.83356 14.6506 13.5632 numMergedOcc 0
163 mol 194 unq 0 iso 1 dist 8.63008 13.445 6.26839 10.977 8.83356 14.6506 15.3582 8.12346 8.0179 13.5632 numMergedOcc 0
164 mol 194 unq 0 iso 2 dist 8.63008 15.3582 8.12346 13.445 6.26839 8.0179 10.977 8.83356 13.5632 14.6506 numMergedOcc 0
165 mol 194 unq 0 iso 3 dist 8.63008 15.3582 8.12346 10.977 8.83356 13.5632 13.445 6.26839 8.0179 14.6506 numMergedOcc 0
166 mol 194 unq 0 iso 4 dist 8.63008 10.977 8.83356 13.445 6.26839 14.6506 15.3582 8.12346 13.5632 8.0179 numMergedOcc 0
167 mol 194 unq 0 iso 5 dist 8.63008 10.977 8.83356 15.3582 8.12346 13.5632 13.445 6.26839 14.6506 8.0179 numMergedOcc 0
168 mol 194 unq 1 iso 0 dist 8.63008 13.445 6.26839 15.3582 8.12346 8.0179 16.6746 8.2654 8.48054 6.26298 numMergedOcc 0
169 mol 194 unq 1 iso 1 dist 8.63008 13.445 6.26839 16.6746 8.2654 8.48054 15.3582 8.12346 8.0179 6.26298 numMergedOcc 0
170 mol 194 unq 1 iso 2 dist 8.63008 15.3582 8.12346 13.445 6.26839 8.0179 16.6746 8.2654 6.26298 8.48054 numMergedOcc 0
171 mol 194 unq 1 iso 3 dist 8.63008 15.3582 8.12346 16.6746 8.2654 6.26298 13.445 6.26839 8.0179 8.48054 numMergedOcc 0
172 mol 194 unq 1 iso 4 dist 8.63008 16.6746 8.2654 13.445 6.26839 8.48054 15.3582 8.12346 6.26298 8.0179 numMergedOcc 0
173 mol 194 unq 1 iso 5 dist 8.63008 16.6746 8.2654 15.3582 8.12346 6.26298 13.445 6.26839 8.48054 8.0179 numMergedOcc 0
174 mol 194 unq 1 iso 0 dist 8.63008 13.445 6.26839 10.977 8.83356 14.6506 16.6746 8.2654 8.48054 11.6097 numMergedOcc 0
175 mol 194 unq 1 iso 1 dist 8.63008 13.445 6.26839 16.6746 8.2654 8.48054 10.977 8.83356 14.6506 11.6097 numMergedOcc 0
176 mol 194 unq 1 iso 2 dist 8.63008 10.977 8.83356 13.445 6.26839 14.6506 16.6746 8.2654 11.6097 8.48054 numMergedOcc 0
177 mol 194 unq 1 iso 3 dist 8.63008 10.977 8.83356 16.6746 8.2654 11.6097 13.445 6.26839 14.6506 8.48054 numMergedOcc 0
178 mol 194 unq 1 iso 4 dist 8.63008 16.6746 8.2654 13.445 6.26839 8.48054 10.977 8.83356 11.6097 14.6506 numMergedOcc 0
179 mol 194 unq 1 iso 5 dist 8.63008 16.6746 8.2654 10.977 8.83356 11.6097 13.445 6.26839 8.48054 14.6506 numMergedOcc 0
180 mol 194 unq 1 iso 0 dist 8.63008 15.3582 8.12346 10.977 8.83356 13.5632 16.6746 8.2654 6.26298 11.6097 numMergedOcc 0
181 mol 194 unq 1 iso 1 dist 8.63008 15.3582 8.12346 16.6746 8.2654 6.26298 10.977 8.83356 13.5632 11.6097 numMergedOcc 0
182 mol 194 unq 1 iso 2 dist 8.63008 10.977 8.83356 15.3582 8.12346 13.5632 16.6746 8.2654 11.6097 6.26298 numMergedOcc 0
183 mol 194 unq 1 iso 3 dist 8.63008 10.977 8.83356 16.6746 8.2654 11.6097 15.3582 8.12346 13.5632 6.26298 numMergedOcc 0
184 mol 194 unq 1 iso 4 dist 8.63008 16.6746 8.2654 15.3582 8.12346 6.26298 10.977 8.83356 11.6097 13.5632 numMergedOcc 0
185 mol 194 unq 1 iso 5 dist 8.63008 16.6746 8.2654 10.977 8.83356 11.6097 15.3582 8.12346 6.26298 13.5632 numMergedOcc 0
186 mol 222 unq 0 iso 0 dist 9.04499 15.0199 9.2581 8.88 9.62632 9.57159 5.68063 7.862 10.5806 6.9154 numMergedOcc 0
187 mol 222 unq 0 iso 1 dist 9.04499 15.0199 9.2581 5.68063 7.862 10.5806 8.88 9.62632 9.57159 6.9154 numMergedOcc 0
188 mol 222 unq 0 iso 2 dist 9.04499 8.88 9.62632 15.0199 9.2581 9.57159 5.68063 7.862 6.9154 10.5806 numMergedOcc 0
189 mol 222 unq 0 iso 3 dist 9.04499 8.88 9.62632 5.68063 7.862 6.9154 15.0199 9.2581 9.57159 10.5806 numMergedOcc 0
190 mol 222 unq 0 iso 4 dist 9.04499 5.68063 7.862 15.0199 9.2581 10.5806 8.88 9.62632 6.9154 9.57159 numMergedOcc 0
191 mol 222 unq 0 iso 5 dist 9.04499 5.68063 7.862 8.88 9.62632 6.9154 15.0199 9.2581 10.5806 9.57159 numMergedOcc 0
192 mol 229 unq 0 iso 0 dist 9.3376 12.696 8.92743 11.6366 8.08082 6.94172 6.44004 5.77318 7.0298 5.5729 numMergedOcc 0
193 mol 229 unq 0 iso 1 dist 9.3376 12.696 8.92743 6.44004 5.77318 7.0298 11.6366 8.08082 6.94172 5.5729 numMergedOcc 0
194 mol 229 unq 0 iso 2 dist 9.3376 11.6366 8.08082 12.696 8.92743 6.94172 6.44004 5.77318 5.5729 7.0298 numMergedOcc 0
195 mol 229 unq 0 iso 3 dist 9.3376 11.6366 8.08082 6.44004 5.77318 5.5729 12.696 8.92743 6.94172 7.0298 numMergedOcc 0
196 mol 229 unq 0 iso 4 dist 9.3376 6.44004 5.77318 12.696 8.92743 7.0298 11.6366 8.08082 5.5729 6.94172 numMergedOcc 0
197 mol 229 unq 0 iso 5 dist 9.3376 6.44004 5.77318 11.6366 8.08082 5.5729 12.696 8.92743 7.0298 6.94172 numMergedOcc 0
198 mol 229 unq 1 iso 0 dist 9.3376 12.696 8.92743 11.6366 8.08082 6.94172 10.442 8.19603 15.7694 11.3041 numMergedOcc 0
199 mol 229 unq 1 iso 1 dist 9.3376 12.696 8.92743 10.442 8.19603 15.7694 11.6366 8.08082 6.94172 11.3041 numMergedOcc 0
200 mol 229 unq 1 iso 2 dist 9.3376 11.6366 8.08082 12.696 8.92743 6.94172 10.442 8.19603 11.3041 15.7694 numMergedOcc 0
201 mol 229 unq 1 iso 3 dist 9.3376 11.6366 8.08082 10.442 8.19603 11.3041 12.696 8.92743 6.94172 15.7694 numMergedOcc 0
202 mol 229 unq 1 iso 4 dist 9.3376 10.442 8.19603 12.696 8.92743 15.7694 11.6366 8.08082 11.3041 6.94172 numMergedOcc 0
203 mol 229 unq 1 iso 5 dist 9.3376 10.442 8.19603 11.6366 8.08082 11.3041 12.696 8.92743 15.7694 6.94172 numMergedOcc 0
204 mol 229 unq 1 iso 0 dist 9.3376 12.696 8.92743 6.44004 5.77318 7.0298 10.442 8.19603 15.7694 9.96077 numMergedOcc 0
205 mol 229 unq 1 iso 1 dist 9.3376 12.696 8.92743 10.442 8.19603 15.7694 6.44004 5.77318 7.0298 9.96077 numMergedOcc 0
206 mol 229 unq 1 iso 2 dist 9.3376 6.44004 5.77318 12.696 8.92743 7.0298 10.442 8.19603 9.96077 15.7694 numMergedOcc 0
207 mol 229 unq 1 iso 3 dist 9.3376 6.44004 5.77318 10.442 8.19603 9.96077 12.696 8.92743 7.0298 15.7694 numMergedOcc 0
208 mol 229 unq 1 iso 4 dist 9.3376 10.442 8.19603 12.696 8.92743 15.7694 6.44004 5.77318 9.96077 7.0298 numMergedOcc 0
209 mol 229 unq 1 iso 5 dist 9.3376 10.442 8.19603 6.44004 5.77318 9.96077 12.696 8.92743 15.7694 7.0298 numMergedOcc 0
210 mol 229 unq 1 iso 0 dist 9.3376 11.6366 8.08082 6.44004 5.77318 5.5729 10.442 8.19603 11.3041 9.96077 numMergedOcc 0
211 mol 229 unq 1 iso 1 dist 9.3376 11.6366 8.08082 10.442 8.19603 11.3041 6.44004 5.77318 5.5729 9.96077 numMergedOcc 0
212 mol 229 unq 1 iso 2 dist 9.3376 6.44004 5.77318 11.6366 8.08082 5.5729 10.442 8.19603 9.96077 11.3041 numMergedOcc 0
213 mol 229 unq 1 iso 3 dist 9.3376 6.44004 5.77318 10.442 8.19603 9.96077 11.6366 8.08082 5.5729 11.3041 numMergedOcc 0
214 mol 229 unq 1 iso 4 dist 9.3376 10.442 8.19603 11.6366 8.08082 11.3041 6.44004 5.77318 9.96077 5.5729 numMergedOcc 0
215 mol 229 unq 1 iso 5 dist 9.3376 10.442 8.19603 6.44004 5.77318 9.96077 11.6366 8.08082 11.3041 5.5729 numMergedOcc 0
216 mol 272 unq 0 iso 0 dist 7.11691 11.9042 9.64269 9.87214 6.88809 6.6954 5.27123 8.46061 8.12676 7.34222 numMergedOcc 0
217 mol 272 unq 0 iso 1 dist 7.11691 11.9042 9.64269 5.27123 8.46061 8.12676 9.87214 6.88809 6.6954 7.34222 numMergedOcc 0
218 mol 272 unq 0 iso 2 dist 7.11691 9.87214 6.88809 11.9042 9.64269 6.6954 5.27123 8.46061 7.34222 8.12676 numMergedOcc 0
219 mol 272 unq 0 iso 3 dist 7.11691 9.87214 6.88809 5.27123 8.46061 7.34222 11.9042 9.64269 6.6954 8.12676 numMergedOcc 0
220 mol 272 unq 0 iso 4 dist 7.11691 5.27123 8.46061 11.9042 9.64269 8.12676 9.87214 6.88809 7.34222 6.6954 numMergedOcc 0
221 mol 272 unq 0 iso 5 dist 7.11691 5.27123 8.46061 9.87214 6.88809 7.34222 11.9042 9.64269 8.12676 6.6954 numMergedOcc 0
