0 mol 54 unq 0 iso 0 dist 5.97635 10.7219 9.5589 6.76462 6.83299 5.08001 13.2619 8.10861 16.3192 14.2075 numMergedOcc 0
1 mol 54 unq 0 iso 1 dist 5.97635 10.7219 9.5589 13.2619 8.10861 16.3192 6.76462 6.83299 5.08001 14.2075 numMergedOcc 0
2 mol 54 unq 0 iso 2 dist 5.97635 6.76462 6.83299 10.7219 9.5589 5.08001 13.2619 8.10861 14.2075 16.3192 numMergedOcc 0
3 mol 54 unq 0 iso 3 dist 5.97635 6.76462 6.83299 13.2619 8.10861 14.2075 10.7219 9.5589 5.08001 16.3192 numMergedOcc 0
4 mol 54 unq 0 iso 4 dist 5.97635 13.2619 8.10861 10.7219 9.5589 16.3192 6.76462 6.83299 14.2075 5.08001 numMergedOcc 0
5 mol 54 unq 0 iso 5 dist 5.97635 13.2619 8.10861 6.76462 6.83299 14.2075 10.7219 9.5589 16.3192 5.08001 numMergedOcc 0
6 mol 75 unq 0 iso 0 dist 6.95595 12.7957 7.79912 10.309 8.56639 5.64643 5.80162 8.59017 10.4899 7.00674 numMergedOcc 0
7 mol 75 unq 0 iso 1 dist 6.95595 12.7957 7.79912 5.80162 8.59017 10.4899 10.309 8.56639 5.64643 7.00674 numMergedOcc 0
8 mol 75 unq 0 iso 2 dist 6.95595 10.309 8.56639 12.7957 7.79912 5.64643 5.80162 8.59017 7.00674 10.4899 numMergedOcc 0
9 mol 75 unq 0 iso 3 dist 6.95595 10.309 8.56639 5.80162 8.59017 7.00674 12.7957 7.79912 5.64643 10.4899 numMergedOcc 0
10 mol 75 unq 0 iso 4 dist 6.95595 5.80162 8.59017 12.7957 7.79912 10.4899 10.309 8.56639 7.00674 5.64643 numMergedOcc 0
11 mol 75 unq 0 iso 5 dist 6.95595 5.80162 8.59017 10.309 8.56639 7.00674 12.7957 7.79912 10.4899 5.64643 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 6.58793 10.1919 7.95579 9.21014 6.19965 4.26409 7.83419 7.66905 10.7229 6.9948 numMergedOcc 0
13 mol 85 unq 0 iso 1 dist 6.58793 10.1919 7.95579 7.83419 7.66905 10.7229 9.21014 6.19965 4.26409 6.9948 numMergedOcc 0
14 mol 85 unq 0 iso 2 dist 6.58793 9.21014 6.19965 10.1919 7.95579 4.26409 7.83419 7.66905 6.9948 10.7229 numMergedOcc 0
15 mol 85 unq 0 iso 3 dist 6.58793 9.21014 6.19965 7.83419 7.66905 6.9948 10.1919 7.95579 4.26409 10.7229 numMergedOcc 0
16 mol 85 unq 0 iso 4 dist 6.58793 7.83419 7.66905 10.1919 7.95579 10.7229 9.21014 6.19965 6.9948 4.26409 numMergedOcc 0
17 mol 85 unq 0 iso 5 dist 6.58793 7.83419 7.66905 9.21014 6.19965 6.9948 10.1919 7.95579 10.7229 4.26409 numMergedOcc 0
18 mol 98 unq 0 iso 0 dist 5.9747 4.75138 5.08437 10.4417 6.48948 9.51923 11.3628 6.10456 8.40073 9.42358 numMergedOcc 0
19 mol 98 unq 0 iso 1 dist 5.9747 4.75138 5.08437 11.3628 6.10456 8.40073 10.4417 6.48948 9.51923 9.42358 numMergedOcc 0
20 mol 98 unq 0 iso 2 dist 5.9747 10.4417 6.48948 4.75138 5.08437 9.51923 11.3628 6.10456 9.42358 8.40073 numMergedOcc 0
21 mol 98 unq 0 iso 3 dist 5.9747 10.4417 6.48948 11.3628 6.10456 9.42358 4.75138 5.08437 9.51923 8.40073 numMergedOcc 0
22 mol 98 unq 0 iso 4 dist 5.9747 11.3628 6.10456 4.75138 5.08437 8.40073 10.4417 6.48948 9.42358 9.51923 numMergedOcc 0
23 mol 98 unq 0 iso 5 dist 5.9747 11.3628 6.10456 10.4417 6.48948 9.42358 4.75138 5.08437 8.40073 9.51923 numMergedOcc 0
24 mol 98 unq 1 iso 0 dist 4.50572 6.88489 5.08437 9.63267 6.48948 9.51923 9.82583 6.10456 8.40073 9.42358 numMergedOcc 0
25 mol 98 unq 1 iso 1 dist 4.50572 6.88489 5.08437 9.82583 6.10456 8.40073 9.63267 6.48948 9.51923 9.42358 numMergedOcc 0
26 mol 98 unq 1 iso 2 dist 4.50572 9.63267 6.48948 6.88489 5.08437 9.51923 9.82583 6.10456 9.42358 8.40073 numMergedOcc 0
27 mol 98 unq 1 iso 3 dist 4.50572 9.63267 6.48948 9.82583 6.10456 9.42358 6.88489 5.08437 9.51923 8.40073 numMergedOcc 0
28 mol 98 unq 1 iso 4 dist 4.50572 9.82583 6.10456 6.88489 5.08437 8.40073 9.63267 6.48948 9.42358 9.51923 numMergedOcc 0
29 mol 98 unq 1 iso 5 dist 4.50572 9.82583 6.10456 9.63267 6.48948 9.42358 6.88489 5.08437 8.40073 9.51923 numMergedOcc 0
30 mol 109 unq 0 iso 0 dist 8.73648 9.47324 7.34473 4.93112 8.58044 7 4.48038 9.97763 8.40993 6.94915 numMergedOcc 0
31 mol 109 unq 0 iso 1 dist 8.73648 9.47324 7.34473 4.48038 9.97763 8.40993 4.93112 8.58044 7 6.94915 numMergedOcc 0
32 mol 109 unq 0 iso 2 dist 8.73648 4.93112 8.58044 9.47324 7.34473 7 4.48038 9.97763 6.94915 8.40993 numMergedOcc 0
33 mol 109 unq 0 iso 3 dist 8.73648 4.93112 8.58044 4.48038 9.97763 6.94915 9.47324 7.34473 7 8.40993 numMergedOcc 0
34 mol 109 unq 0 iso 4 dist 8.73648 4.48038 9.97763 9.47324 7.34473 8.40993 4.93112 8.58044 6.94915 7 numMergedOcc 0
35 mol 109 unq 0 iso 5 dist 8.73648 4.48038 9.97763 4.93112 8.58044 6.94915 9.47324 7.34473 8.40993 7 numMergedOcc 0
36 mol 115 unq 0 iso 0 dist 5.02717 5.28901 7.30858 6.75472 5.83991 10.8507 11.0268 7.88312 11.5723 8.02349 numMergedOcc 0
37 mol 115 unq 0 iso 1 dist 5.02717 5.28901 7.30858 11.0268 7.88312 11.5723 6.75472 5.83991 10.8507 8.02349 numMergedOcc 0
38 mol 115 unq 0 iso 2 dist 5.02717 6.75472 5.83991 5.28901 7.30858 10.8507 11.0268 7.88312 8.02349 11.5723 numMergedOcc 0
39 mol 115 unq 0 iso 3 dist 5.02717 6.75472 5.83991 11.0268 7.88312 8.02349 5.28901 7.30858 10.8507 11.5723 numMergedOcc 0
40 mol 115 unq 0 iso 4 dist 5.02717 11.0268 7.88312 5.28901 7.30858 11.5723 6.75472 5.83991 8.02349 10.8507 numMergedOcc 0
41 mol 115 unq 0 iso 5 dist 5.02717 11.0268 7.88312 6.75472 5.83991 8.02349 5.28901 7.30858 11.5723 10.8507 numMergedOcc 0
42 mol 117 unq 0 iso 0 dist 6.90827 10.4485 7.90328 5.27151 7.83136 7.22206 4.45276 7.0603 9.3584 7.21564 numMergedOcc 0
43 mol 117 unq 0 iso 1 dist 6.90827 10.4485 7.90328 4.45276 7.0603 9.3584 5.27151 7.83136 7.22206 7.21564 numMergedOcc 0
44 mol 117 unq 0 iso 2 dist 6.90827 5.27151 7.83136 10.4485 7.90328 7.22206 4.45276 7.0603 7.21564 9.3584 numMergedOcc 0
45 mol 117 unq 0 iso 3 dist 6.90827 5.27151 7.83136 4.45276 7.0603 7.21564 10.4485 7.90328 7.22206 9.3584 numMergedOcc 0
46 mol 117 unq 0 iso 4 dist 6.90827 4.45276 7.0603 10.4485 7.90328 9.3584 5.27151 7.83136 7.21564 7.22206 numMergedOcc 0
47 mol 117 unq 0 iso 5 dist 6.90827 4.45276 7.0603 5.27151 7.83136 7.21564 10.4485 7.90328 9.3584 7.22206 numMergedOcc 0
48 mol 117 unq 1 iso 0 dist 8.90977 13.8755 7.90328 10.6616 7.83136 7.22206 4.98254 7.0603 9.3584 7.21564 numMergedOcc 0
49 mol 117 unq 1 iso 1 dist 8.90977 13.8755 7.90328 4.98254 7.0603 9.3584 10.6616 7.83136 7.22206 7.21564 numMergedOcc 0
50 mol 117 unq 1 iso 2 dist 8.90977 10.6616 7.83136 13.8755 7.90328 7.22206 4.98254 7.0603 7.21564 9.3584 numMergedOcc 0
51 mol 117 unq 1 iso 3 dist 8.90977 10.6616 7.83136 4.98254 7.0603 7.21564 13.8755 7.90328 7.22206 9.3584 numMergedOcc 0
52 mol 117 unq 1 iso 4 dist 8.90977 4.98254 7.0603 13.8755 7.90328 9.3584 10.6616 7.83136 7.21564 7.22206 numMergedOcc 0
53 mol 117 unq 1 iso 5 dist 8.90977 4.98254 7.0603 10.6616 7.83136 7.21564 13.8755 7.90328 9.3584 7.22206 numMergedOcc 0
54 mol 131 unq 0 iso 0 dist 6.31125 5.6098 8.40312 4.29914 7.12972 5.55373 5.59449 6.85062 10.7062 6.63273 numMergedOcc 0
55 mol 131 unq 0 iso 1 dist 6.31125 5.6098 8.40312 5.59449 6.85062 10.7062 4.29914 7.12972 5.55373 6.63273 numMergedOcc 0
56 mol 131 unq 0 iso 2 dist 6.31125 4.29914 7.12972 5.6098 8.40312 5.55373 5.59449 6.85062 6.63273 10.7062 numMergedOcc 0
57 mol 131 unq 0 iso 3 dist 6.31125 4.29914 7.12972 5.59449 6.85062 6.63273 5.6098 8.40312 5.55373 10.7062 numMergedOcc 0
58 mol 131 unq 0 iso 4 dist 6.31125 5.59449 6.85062 5.6098 8.40312 10.7062 4.29914 7.12972 6.63273 5.55373 numMergedOcc 0
59 mol 131 unq 0 iso 5 dist 6.31125 5.59449 6.85062 4.29914 7.12972 6.63273 5.6098 8.40312 10.7062 5.55373 numMergedOcc 0
60 mol 133 unq 0 iso 0 dist 5.82404 10.2385 6.29155 4.64588 6.80239 7.81217 5.37072 8.00618 11.965 7.79672 numMergedOcc 0
61 mol 133 unq 0 iso 1 dist 5.82404 10.2385 6.29155 5.37072 8.00618 11.965 4.64588 6.80239 7.81217 7.79672 numMergedOcc 0
62 mol 133 unq 0 iso 2 dist 5.82404 4.64588 6.80239 10.2385 6.29155 7.81217 5.37072 8.00618 7.79672 11.965 numMergedOcc 0
63 mol 133 unq 0 iso 3 dist 5.82404 4.64588 6.80239 5.37072 8.00618 7.79672 10.2385 6.29155 7.81217 11.965 numMergedOcc 0
64 mol 133 unq 0 iso 4 dist 5.82404 5.37072 8.00618 10.2385 6.29155 11.965 4.64588 6.80239 7.79672 7.81217 numMergedOcc 0
65 mol 133 unq 0 iso 5 dist 5.82404 5.37072 8.00618 4.64588 6.80239 7.79672 10.2385 6.29155 11.965 7.81217 numMergedOcc 0
66 mol 152 unq 0 iso 0 dist 8.07256 10.4039 8.56324 11.1874 6.70283 7.65448 8.36099 7.16148 10.6875 5.49936 numMergedOcc 0
67 mol 152 unq 0 iso 1 dist 8.07256 10.4039 8.56324 8.36099 7.16148 10.6875 11.1874 6.70283 7.65448 5.49936 numMergedOcc 0
68 mol 152 unq 0 iso 2 dist 8.07256 11.1874 6.70283 10.4039 8.56324 7.65448 8.36099 7.16148 5.49936 10.6875 numMergedOcc 0
69 mol 152 unq 0 iso 3 dist 8.07256 11.1874 6.70283 8.36099 7.16148 5.49936 10.4039 8.56324 7.65448 10.6875 numMergedOcc 0
70 mol 152 unq 0 iso 4 dist 8.07256 8.36099 7.16148 10.4039 8.56324 10.6875 11.1874 6.70283 5.49936 7.65448 numMergedOcc 0
71 mol 152 unq 0 iso 5 dist 8.07256 8.36099 7.16148 11.1874 6.70283 5.49936 10.4039 8.56324 10.6875 7.65448 numMergedOcc 0
72 mol 205 unq 0 iso 0 dist 5.96555 4.6995 6.03031 10.7091 7.26832 7.38516 5.87892 7.80463 8.18714 13.8543 numMergedOcc 0
73 mol 205 unq 0 iso 1 dist 5.96555 4.6995 6.03031 5.87892 7.80463 8.18714 10.7091 7.26832 7.38516 13.8543 numMergedOcc 0
74 mol 205 unq 0 iso 2 dist 5.96555 10.7091 7.26832 4.6995 6.03031 7.38516 5.87892 7.80463 13.8543 8.18714 numMergedOcc 0
75 mol 205 unq 0 iso 3 dist 5.96555 10.7091 7.26832 5.87892 7.80463 13.8543 4.6995 6.03031 7.38516 8.18714 numMergedOcc 0
76 mol 205 unq 0 iso 4 dist 5.96555 5.87892 7.80463 4.6995 6.03031 8.18714 10.7091 7.26832 13.8543 7.38516 numMergedOcc 0
77 mol 205 unq 0 iso 5 dist 5.96555 5.87892 7.80463 10.7091 7.26832 13.8543 4.6995 6.03031 8.18714 7.38516 numMergedOcc 0
78 mol 214 unq 0 iso 0 dist 9.51764 6.28065 9.65138 11.2159 7.14453 9.10746 6.53326 8.85478 4.40923 11.3796 numMergedOcc 0
79 mol 214 unq 0 iso 1 dist 9.51764 6.28065 9.65138 6.53326 8.85478 4.40923 11.2159 7.14453 9.10746 11.3796 numMergedOcc 0
80 mol 214 unq 0 iso 2 dist 9.51764 11.2159 7.14453 6.28065 9.65138 9.10746 6.53326 8.85478 11.3796 4.40923 numMergedOcc 0
81 mol 214 unq 0 iso 3 dist 9.51764 11.2159 7.14453 6.53326 8.85478 11.3796 6.28065 9.65138 9.10746 4.40923 numMergedOcc 0
82 mol 214 unq 0 iso 4 dist 9.51764 6.53326 8.85478 6.28065 9.65138 4.40923 11.2159 7.14453 11.3796 9.10746 numMergedOcc 0
83 mol 214 unq 0 iso 5 dist 9.51764 6.53326 8.85478 11.2159 7.14453 11.3796 6.28065 9.65138 4.40923 9.10746 numMergedOcc 0
84 mol 214 unq 1 iso 0 dist 5.36829 11.7583 9.65138 4.98764 7.14453 9.10746 12.3481 8.85478 4.40923 11.3796 numMergedOcc 0
85 mol 214 unq 1 iso 1 dist 5.36829 11.7583 9.65138 12.3481 8.85478 4.40923 4.98764 7.14453 9.10746 11.3796 numMergedOcc 0
86 mol 214 unq 1 iso 2 dist 5.36829 4.98764 7.14453 11.7583 9.65138 9.10746 12.3481 8.85478 11.3796 4.40923 numMergedOcc 0
87 mol 214 unq 1 iso 3 dist 5.36829 4.98764 7.14453 12.3481 8.85478 11.3796 11.7583 9.65138 9.10746 4.40923 numMergedOcc 0
88 mol 214 unq 1 iso 4 dist 5.36829 12.3481 8.85478 11.7583 9.65138 4.40923 4.98764 7.14453 11.3796 9.10746 numMergedOcc 0
89 mol 214 unq 1 iso 5 dist 5.36829 12.3481 8.85478 4.98764 7.14453 11.3796 11.7583 9.65138 4.40923 9.10746 numMergedOcc 0
90 mol 222 unq 0 iso 0 dist 9.55777 6.54251 8.01589 15.3892 7.7699 10.4579 16.4881 7.21333 13.3522 5.24516 numMergedOcc 0
91 mol 222 unq 0 iso 1 dist 9.55777 6.54251 8.01589 16.4881 7.21333 13.3522 15.3892 7.7699 10.4579 5.24516 numMergedOcc 0
92 mol 222 unq 0 iso 2 dist 9.55777 15.3892 7.7699 6.54251 8.01589 10.4579 16.4881 7.21333 5.24516 13.3522 numMergedOcc 0
93 mol 222 unq 0 iso 3 dist 9.55777 15.3892 7.7699 16.4881 7.21333 5.24516 6.54251 8.01589 10.4579 13.3522 numMergedOcc 0
94 mol 222 unq 0 iso 4 dist 9.55777 16.4881 7.21333 6.54251 8.01589 13.3522 15.3892 7.7699 5.24516 10.4579 numMergedOcc 0
95 mol 222 unq 0 iso 5 dist 9.55777 16.4881 7.21333 15.3892 7.7699 5.24516 6.54251 8.01589 13.3522 10.4579 numMergedOcc 0
96 mol 224 unq 0 iso 0 dist 8.39002 9.98893 8.95269 5.72088 6.57273 4.70378 6.51315 5.78342 11.5372 8.49799 numMergedOcc 0
97 mol 224 unq 0 iso 1 dist 8.39002 9.98893 8.95269 6.51315 5.78342 11.5372 5.72088 6.57273 4.70378 8.49799 numMergedOcc 0
98 mol 224 unq 0 iso 2 dist 8.39002 5.72088 6.57273 9.98893 8.95269 4.70378 6.51315 5.78342 8.49799 11.5372 numMergedOcc 0
99 mol 224 unq 0 iso 3 dist 8.39002 5.72088 6.57273 6.51315 5.78342 8.49799 9.98893 8.95269 4.70378 11.5372 numMergedOcc 0
100 mol 224 unq 0 iso 4 dist 8.39002 6.51315 5.78342 9.98893 8.95269 11.5372 5.72088 6.57273 8.49799 4.70378 numMergedOcc 0
101 mol 224 unq 0 iso 5 dist 8.39002 6.51315 5.78342 5.72088 6.57273 8.49799 9.98893 8.95269 11.5372 4.70378 numMergedOcc 0
102 mol 224 unq 1 iso 0 dist 8.46129 6.31508 6.65832 5.72088 6.60589 6.77699 6.51315 9.16166 11.328 8.49799 numMergedOcc 0
103 mol 224 unq 1 iso 1 dist 8.46129 6.31508 6.65832 6.51315 9.16166 11.328 5.72088 6.60589 6.77699 8.49799 numMergedOcc 0
104 mol 224 unq 1 iso 2 dist 8.46129 5.72088 6.60589 6.31508 6.65832 6.77699 6.51315 9.16166 8.49799 11.328 numMergedOcc 0
105 mol 224 unq 1 iso 3 dist 8.46129 5.72088 6.60589 6.51315 9.16166 8.49799 6.31508 6.65832 6.77699 11.328 numMergedOcc 0
106 mol 224 unq 1 iso 4 dist 8.46129 6.51315 9.16166 6.31508 6.65832 11.328 5.72088 6.60589 8.49799 6.77699 numMergedOcc 0
107 mol 224 unq 1 iso 5 dist 8.46129 6.51315 9.16166 5.72088 6.60589 8.49799 6.31508 6.65832 11.328 6.77699 numMergedOcc 0
108 mol 236 unq 0 iso 0 dist 8.90987 5.26654 8.03456 3.82437 6.84306 5.79505 13.8124 9.99038 9.90963 11.3368 numMergedOcc 0
109 mol 236 unq 0 iso 1 dist 8.90987 5.26654 8.03456 13.8124 9.99038 9.90963 3.82437 6.84306 5.79505 11.3368 numMergedOcc 0
110 mol 236 unq 0 iso 2 dist 8.90987 3.82437 6.84306 5.26654 8.03456 5.79505 13.8124 9.99038 11.3368 9.90963 numMergedOcc 0
111 mol 236 unq 0 iso 3 dist 8.90987 3.82437 6.84306 13.8124 9.99038 11.3368 5.26654 8.03456 5.79505 9.90963 numMergedOcc 0
112 mol 236 unq 0 iso 4 dist 8.90987 13.8124 9.99038 5.26654 8.03456 9.90963 3.82437 6.84306 11.3368 5.79505 numMergedOcc 0
113 mol 236 unq 0 iso 5 dist 8.90987 13.8124 9.99038 3.82437 6.84306 11.3368 5.26654 8.03456 9.90963 5.79505 numMergedOcc 0
114 mol 236 unq 1 iso 0 dist 8.90987 5.26654 8.03456 3.82437 6.84306 5.79505 11.2846 9.78037 6.96005 11.8739 numMergedOcc 0
115 mol 236 unq 1 iso 1 dist 8.90987 5.26654 8.03456 11.2846 9.78037 6.96005 3.82437 6.84306 5.79505 11.8739 numMergedOcc 0
116 mol 236 unq 1 iso 2 dist 8.90987 3.82437 6.84306 5.26654 8.03456 5.79505 11.2846 9.78037 11.8739 6.96005 numMergedOcc 0
117 mol 236 unq 1 iso 3 dist 8.90987 3.82437 6.84306 11.2846 9.78037 11.8739 5.26654 8.03456 5.79505 6.96005 numMergedOcc 0
118 mol 236 unq 1 iso 4 dist 8.90987 11.2846 9.78037 5.26654 8.03456 6.96005 3.82437 6.84306 11.8739 5.79505 numMergedOcc 0
119 mol 236 unq 1 iso 5 dist 8.90987 11.2846 9.78037 3.82437 6.84306 11.8739 5.26654 8.03456 6.96005 5.79505 numMergedOcc 0
120 mol 236 unq 2 iso 0 dist 8.90987 5.26654 8.03456 3.82437 6.84306 5.79505 16.8883 8.35971 14.2337 14.7998 numMergedOcc 0
121 mol 236 unq 2 iso 1 dist 8.90987 5.26654 8.03456 16.8883 8.35971 14.2337 3.82437 6.84306 5.79505 14.7998 numMergedOcc 0
122 mol 236 unq 2 iso 2 dist 8.90987 3.82437 6.84306 5.26654 8.03456 5.79505 16.8883 8.35971 14.7998 14.2337 numMergedOcc 0
123 mol 236 unq 2 iso 3 dist 8.90987 3.82437 6.84306 16.8883 8.35971 14.7998 5.26654 8.03456 5.79505 14.2337 numMergedOcc 0
124 mol 236 unq 2 iso 4 dist 8.90987 16.8883 8.35971 5.26654 8.03456 14.2337 3.82437 6.84306 14.7998 5.79505 numMergedOcc 0
125 mol 236 unq 2 iso 5 dist 8.90987 16.8883 8.35971 3.82437 6.84306 14.7998 5.26654 8.03456 14.2337 5.79505 numMergedOcc 0
126 mol 236 unq 1 iso 0 dist 8.90987 5.26654 8.03456 13.8124 9.99038 9.90963 11.2846 9.78037 6.96005 11.1557 numMergedOcc 0
127 mol 236 unq 1 iso 1 dist 8.90987 5.26654 8.03456 11.2846 9.78037 6.96005 13.8124 9.99038 9.90963 11.1557 numMergedOcc 0
128 mol 236 unq 1 iso 2 dist 8.90987 13.8124 9.99038 5.26654 8.03456 9.90963 11.2846 9.78037 11.1557 6.96005 numMergedOcc 0
129 mol 236 unq 1 iso 3 dist 8.90987 13.8124 9.99038 11.2846 9.78037 11.1557 5.26654 8.03456 9.90963 6.96005 numMergedOcc 0
130 mol 236 unq 1 iso 4 dist 8.90987 11.2846 9.78037 5.26654 8.03456 6.96005 13.8124 9.99038 11.1557 9.90963 numMergedOcc 0
131 mol 236 unq 1 iso 5 dist 8.90987 11.2846 9.78037 13.8124 9.99038 11.1557 5.26654 8.03456 6.96005 9.90963 numMergedOcc 0
132 mol 236 unq 2 iso 0 dist 8.90987 5.26654 8.03456 13.8124 9.99038 9.90963 16.8883 8.35971 14.2337 10.7497 numMergedOcc 0
133 mol 236 unq 2 iso 1 dist 8.90987 5.26654 8.03456 16.8883 8.35971 14.2337 13.8124 9.99038 9.90963 10.7497 numMergedOcc 0
134 mol 236 unq 2 iso 2 dist 8.90987 13.8124 9.99038 5.26654 8.03456 9.90963 16.8883 8.35971 10.7497 14.2337 numMergedOcc 0
135 mol 236 unq 2 iso 3 dist 8.90987 13.8124 9.99038 16.8883 8.35971 10.7497 5.26654 8.03456 9.90963 14.2337 numMergedOcc 0
136 mol 236 unq 2 iso 4 dist 8.90987 16.8883 8.35971 5.26654 8.03456 14.2337 13.8124 9.99038 10.7497 9.90963 numMergedOcc 0
137 mol 236 unq 2 iso 5 dist 8.90987 16.8883 8.35971 13.8124 9.99038 10.7497 5.26654 8.03456 14.2337 9.90963 numMergedOcc 0
138 mol 236 unq 2 iso 0 dist 8.90987 5.26654 8.03456 11.2846 9.78037 6.96005 16.8883 8.35971 14.2337 12.0369 numMergedOcc 0
139 mol 236 unq 2 iso 1 dist 8.90987 5.26654 8.03456 16.8883 8.35971 14.2337 11.2846 9.78037 6.96005 12.0369 numMergedOcc 0
140 mol 236 unq 2 iso 2 dist 8.90987 11.2846 9.78037 5.26654 8.03456 6.96005 16.8883 8.35971 12.0369 14.2337 numMergedOcc 0
141 mol 236 unq 2 iso 3 dist 8.90987 11.2846 9.78037 16.8883 8.35971 12.0369 5.26654 8.03456 6.96005 14.2337 numMergedOcc 0
142 mol 236 unq 2 iso 4 dist 8.90987 16.8883 8.35971 5.26654 8.03456 14.2337 11.2846 9.78037 12.0369 6.96005 numMergedOcc 0
143 mol 236 unq 2 iso 5 dist 8.90987 16.8883 8.35971 11.2846 9.78037 12.0369 5.26654 8.03456 14.2337 6.96005 numMergedOcc 0
144 mol 236 unq 1 iso 0 dist 8.90987 3.82437 6.84306 13.8124 9.99038 11.3368 11.2846 9.78037 11.8739 11.1557 numMergedOcc 0
145 mol 236 unq 1 iso 1 dist 8.90987 3.82437 6.84306 11.2846 9.78037 11.8739 13.8124 9.99038 11.3368 11.1557 numMergedOcc 0
146 mol 236 unq 1 iso 2 dist 8.90987 13.8124 9.99038 3.82437 6.84306 11.3368 11.2846 9.78037 11.1557 11.8739 numMergedOcc 0
147 mol 236 unq 1 iso 3 dist 8.90987 13.8124 9.99038 11.2846 9.78037 11.1557 3.82437 6.84306 11.3368 11.8739 numMergedOcc 0
148 mol 236 unq 1 iso 4 dist 8.90987 11.2846 9.78037 3.82437 6.84306 11.8739 13.8124 9.99038 11.1557 11.3368 numMergedOcc 0
149 mol 236 unq 1 iso 5 dist 8.90987 11.2846 9.78037 13.8124 9.99038 11.1557 3.82437 6.84306 11.8739 11.3368 numMergedOcc 0
150 mol 236 unq 2 iso 0 dist 8.90987 3.82437 6.84306 13.8124 9.99038 11.3368 16.8883 8.35971 14.7998 10.7497 numMergedOcc 0
151 mol 236 unq 2 iso 1 dist 8.90987 3.82437 6.84306 16.8883 8.35971 14.7998 13.8124 9.99038 11.3368 10.7497 numMergedOcc 0
152 mol 236 unq 2 iso 2 dist 8.90987 13.8124 9.99038 3.82437 6.84306 11.3368 16.8883 8.35971 10.7497 14.7998 numMergedOcc 0
153 mol 236 unq 2 iso 3 dist 8.90987 13.8124 9.99038 16.8883 8.35971 10.7497 3.82437 6.84306 11.3368 14.7998 numMergedOcc 0
154 mol 236 unq 2 iso 4 dist 8.90987 16.8883 8.35971 3.82437 6.84306 14.7998 13.8124 9.99038 10.7497 11.3368 numMergedOcc 0
155 mol 236 unq 2 iso 5 dist 8.90987 16.8883 8.35971 13.8124 9.99038 10.7497 3.82437 6.84306 14.7998 11.3368 numMergedOcc 0
156 mol 236 unq 2 iso 0 dist 8.90987 3.82437 6.84306 11.2846 9.78037 11.8739 16.8883 8.35971 14.7998 12.0369 numMergedOcc 0
157 mol 236 unq 2 iso 1 dist 8.90987 3.82437 6.84306 16.8883 8.35971 14.7998 11.2846 9.78037 11.8739 12.0369 numMergedOcc 0
158 mol 236 unq 2 iso 2 dist 8.90987 11.2846 9.78037 3.82437 6.84306 11.8739 16.8883 8.35971 12.0369 14.7998 numMergedOcc 0
159 mol 236 unq 2 iso 3 dist 8.90987 11.2846 9.78037 16.8883 8.35971 12.0369 3.82437 6.84306 11.8739 14.7998 numMergedOcc 0
160 mol 236 unq 2 iso 4 dist 8.90987 16.8883 8.35971 3.82437 6.84306 14.7998 11.2846 9.78037 12.0369 11.8739 numMergedOcc 0
161 mol 236 unq 2 iso 5 dist 8.90987 16.8883 8.35971 11.2846 9.78037 12.0369 3.82437 6.84306 14.7998 11.8739 numMergedOcc 0
162 mol 236 unq 2 iso 0 dist 8.90987 13.8124 9.99038 11.2846 9.78037 11.1557 16.8883 8.35971 10.7497 12.0369 numMergedOcc 0
163 mol 236 unq 2 iso 1 dist 8.90987 13.8124 9.99038 16.8883 8.35971 10.7497 11.2846 9.78037 11.1557 12.0369 numMergedOcc 0
164 mol 236 unq 2 iso 2 dist 8.90987 11.2846 9.78037 13.8124 9.99038 11.1557 16.8883 8.35971 12.0369 10.7497 numMergedOcc 0
165 mol 236 unq 2 iso 3 dist 8.90987 11.2846 9.78037 16.8883 8.35971 12.0369 13.8124 9.99038 11.1557 10.7497 numMergedOcc 0
166 mol 236 unq 2 iso 4 dist 8.90987 16.8883 8.35971 13.8124 9.99038 10.7497 11.2846 9.78037 12.0369 11.1557 numMergedOcc 0
167 mol 236 unq 2 iso 5 dist 8.90987 16.8883 8.35971 11.2846 9.78037 12.0369 13.8124 9.99038 10.7497 11.1557 numMergedOcc 0
