0 mol 24 unq 0 iso 0 dist 8.86116 8.38394 6.44287 8.60554 8.52463 12.3994 8.44664 10.971 5.30734 14.1496 numMergedOcc 0
1 mol 24 unq 0 iso 1 dist 8.86116 8.38394 6.44287 8.44664 10.971 5.30734 8.60554 8.52463 12.3994 14.1496 numMergedOcc 0
2 mol 24 unq 0 iso 2 dist 8.38394 8.86116 6.44287 8.60554 12.3994 8.52463 8.44664 5.30734 10.971 14.1496 numMergedOcc 0
3 mol 24 unq 0 iso 3 dist 8.38394 8.86116 6.44287 8.44664 5.30734 10.971 8.60554 12.3994 8.52463 14.1496 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.86116 8.38394 6.44287 8.60554 8.52463 12.3994 9.44691 13.4893 12.505 9.62033 numMergedOcc 0
5 mol 24 unq 1 iso 1 dist 8.86116 8.38394 6.44287 9.44691 13.4893 12.505 8.60554 8.52463 12.3994 9.62033 numMergedOcc 0
6 mol 24 unq 1 iso 2 dist 8.38394 8.86116 6.44287 8.60554 12.3994 8.52463 9.44691 12.505 13.4893 9.62033 numMergedOcc 0
7 mol 24 unq 1 iso 3 dist 8.38394 8.86116 6.44287 9.44691 12.505 13.4893 8.60554 12.3994 8.52463 9.62033 numMergedOcc 0
8 mol 24 unq 1 iso 0 dist 8.86116 8.38394 6.44287 8.44664 10.971 5.30734 9.44691 13.4893 12.505 10.4263 numMergedOcc 0
9 mol 24 unq 1 iso 1 dist 8.86116 8.38394 6.44287 9.44691 13.4893 12.505 8.44664 10.971 5.30734 10.4263 numMergedOcc 0
10 mol 24 unq 1 iso 2 dist 8.38394 8.86116 6.44287 8.44664 5.30734 10.971 9.44691 12.505 13.4893 10.4263 numMergedOcc 0
11 mol 24 unq 1 iso 3 dist 8.38394 8.86116 6.44287 9.44691 12.505 13.4893 8.44664 5.30734 10.971 10.4263 numMergedOcc 0
12 mol 24 unq 2 iso 0 dist 5.54419 7.36323 12.3067 8.4051 5.11617 13.2229 8.23446 13.1779 6.38336 14.1082 numMergedOcc 0
13 mol 24 unq 2 iso 1 dist 5.54419 7.36323 12.3067 8.23446 13.1779 6.38336 8.4051 5.11617 13.2229 14.1082 numMergedOcc 0
14 mol 24 unq 2 iso 2 dist 7.36323 5.54419 12.3067 8.4051 13.2229 5.11617 8.23446 6.38336 13.1779 14.1082 numMergedOcc 0
15 mol 24 unq 2 iso 3 dist 7.36323 5.54419 12.3067 8.23446 6.38336 13.1779 8.4051 13.2229 5.11617 14.1082 numMergedOcc 0
16 mol 24 unq 3 iso 0 dist 5.54419 7.36323 12.3067 8.4051 5.11617 13.2229 8.75662 10.8238 6.7828 9.62033 numMergedOcc 0
17 mol 24 unq 3 iso 1 dist 5.54419 7.36323 12.3067 8.75662 10.8238 6.7828 8.4051 5.11617 13.2229 9.62033 numMergedOcc 0
18 mol 24 unq 3 iso 2 dist 7.36323 5.54419 12.3067 8.4051 13.2229 5.11617 8.75662 6.7828 10.8238 9.62033 numMergedOcc 0
19 mol 24 unq 3 iso 3 dist 7.36323 5.54419 12.3067 8.75662 6.7828 10.8238 8.4051 13.2229 5.11617 9.62033 numMergedOcc 0
20 mol 24 unq 3 iso 0 dist 5.54419 7.36323 12.3067 8.23446 13.1779 6.38336 8.75662 10.8238 6.7828 11.342 numMergedOcc 0
21 mol 24 unq 3 iso 1 dist 5.54419 7.36323 12.3067 8.75662 10.8238 6.7828 8.23446 13.1779 6.38336 11.342 numMergedOcc 0
22 mol 24 unq 3 iso 2 dist 7.36323 5.54419 12.3067 8.23446 6.38336 13.1779 8.75662 6.7828 10.8238 11.342 numMergedOcc 0
23 mol 24 unq 3 iso 3 dist 7.36323 5.54419 12.3067 8.75662 6.7828 10.8238 8.23446 6.38336 13.1779 11.342 numMergedOcc 0
24 mol 25 unq 0 iso 0 dist 7.57578 7.17969 4.33106 6.16347 9.34396 10.8498 7.92503 6.11127 5.30154 12.7398 numMergedOcc 0
25 mol 25 unq 0 iso 1 dist 7.57578 7.17969 4.33106 7.92503 6.11127 5.30154 6.16347 9.34396 10.8498 12.7398 numMergedOcc 0
26 mol 25 unq 0 iso 2 dist 7.17969 7.57578 4.33106 6.16347 10.8498 9.34396 7.92503 5.30154 6.11127 12.7398 numMergedOcc 0
27 mol 25 unq 0 iso 3 dist 7.17969 7.57578 4.33106 7.92503 5.30154 6.11127 6.16347 10.8498 9.34396 12.7398 numMergedOcc 0
28 mol 92 unq 0 iso 0 dist 9.33898 9.64443 13.1316 8.91313 17.5889 13.3881 8.16392 10.8304 5.90097 11.5449 numMergedOcc 0
29 mol 92 unq 0 iso 1 dist 9.33898 9.64443 13.1316 8.16392 10.8304 5.90097 8.91313 17.5889 13.3881 11.5449 numMergedOcc 0
30 mol 92 unq 0 iso 2 dist 9.64443 9.33898 13.1316 8.91313 13.3881 17.5889 8.16392 5.90097 10.8304 11.5449 numMergedOcc 0
31 mol 92 unq 0 iso 3 dist 9.64443 9.33898 13.1316 8.16392 5.90097 10.8304 8.91313 13.3881 17.5889 11.5449 numMergedOcc 0
32 mol 92 unq 1 iso 0 dist 7.4729 6.82344 8.95922 6.95572 9.50382 7.56363 7.38677 12.7565 5.91004 6.36037 numMergedOcc 0
33 mol 92 unq 1 iso 1 dist 7.4729 6.82344 8.95922 7.38677 12.7565 5.91004 6.95572 9.50382 7.56363 6.36037 numMergedOcc 0
34 mol 92 unq 1 iso 2 dist 6.82344 7.4729 8.95922 6.95572 7.56363 9.50382 7.38677 5.91004 12.7565 6.36037 numMergedOcc 0
35 mol 92 unq 1 iso 3 dist 6.82344 7.4729 8.95922 7.38677 5.91004 12.7565 6.95572 7.56363 9.50382 6.36037 numMergedOcc 0
36 mol 100 unq 0 iso 0 dist 7.47343 6.65086 8.8807 8.30845 12.2861 5.80144 8.76378 15.5385 12.3577 13.3504 numMergedOcc 0
37 mol 100 unq 0 iso 1 dist 7.47343 6.65086 8.8807 8.76378 15.5385 12.3577 8.30845 12.2861 5.80144 13.3504 numMergedOcc 0
38 mol 100 unq 0 iso 2 dist 6.65086 7.47343 8.8807 8.30845 5.80144 12.2861 8.76378 12.3577 15.5385 13.3504 numMergedOcc 0
39 mol 100 unq 0 iso 3 dist 6.65086 7.47343 8.8807 8.76378 12.3577 15.5385 8.30845 5.80144 12.2861 13.3504 numMergedOcc 0
40 mol 100 unq 1 iso 0 dist 7.47343 6.56369 12.6515 8.30845 12.2861 10.0456 8.76378 15.5385 4.97045 13.3504 numMergedOcc 0
41 mol 100 unq 1 iso 1 dist 7.47343 6.56369 12.6515 8.76378 15.5385 4.97045 8.30845 12.2861 10.0456 13.3504 numMergedOcc 0
42 mol 100 unq 1 iso 2 dist 6.56369 7.47343 12.6515 8.30845 10.0456 12.2861 8.76378 4.97045 15.5385 13.3504 numMergedOcc 0
43 mol 100 unq 1 iso 3 dist 6.56369 7.47343 12.6515 8.76378 4.97045 15.5385 8.30845 10.0456 12.2861 13.3504 numMergedOcc 0
44 mol 100 unq 2 iso 0 dist 7.47343 9.30209 13.887 8.30845 12.2861 6.70236 8.76378 15.5385 10.7791 13.3504 numMergedOcc 0
45 mol 100 unq 2 iso 1 dist 7.47343 9.30209 13.887 8.76378 15.5385 10.7791 8.30845 12.2861 6.70236 13.3504 numMergedOcc 0
46 mol 100 unq 2 iso 2 dist 9.30209 7.47343 13.887 8.30845 6.70236 12.2861 8.76378 10.7791 15.5385 13.3504 numMergedOcc 0
47 mol 100 unq 2 iso 3 dist 9.30209 7.47343 13.887 8.76378 10.7791 15.5385 8.30845 6.70236 12.2861 13.3504 numMergedOcc 0
48 mol 100 unq 1 iso 0 dist 6.65086 6.56369 7.80879 8.30845 5.80144 10.0456 8.76378 12.3577 4.97045 13.3504 numMergedOcc 0
49 mol 100 unq 1 iso 1 dist 6.65086 6.56369 7.80879 8.76378 12.3577 4.97045 8.30845 5.80144 10.0456 13.3504 numMergedOcc 0
50 mol 100 unq 1 iso 2 dist 6.56369 6.65086 7.80879 8.30845 10.0456 5.80144 8.76378 4.97045 12.3577 13.3504 numMergedOcc 0
51 mol 100 unq 1 iso 3 dist 6.56369 6.65086 7.80879 8.76378 4.97045 12.3577 8.30845 10.0456 5.80144 13.3504 numMergedOcc 0
52 mol 100 unq 2 iso 0 dist 6.65086 9.30209 5.38414 8.30845 5.80144 6.70236 8.76378 12.3577 10.7791 13.3504 numMergedOcc 0
53 mol 100 unq 2 iso 1 dist 6.65086 9.30209 5.38414 8.76378 12.3577 10.7791 8.30845 5.80144 6.70236 13.3504 numMergedOcc 0
54 mol 100 unq 2 iso 2 dist 9.30209 6.65086 5.38414 8.30845 6.70236 5.80144 8.76378 10.7791 12.3577 13.3504 numMergedOcc 0
55 mol 100 unq 2 iso 3 dist 9.30209 6.65086 5.38414 8.76378 10.7791 12.3577 8.30845 6.70236 5.80144 13.3504 numMergedOcc 0
56 mol 100 unq 2 iso 0 dist 6.56369 9.30209 6.39938 8.30845 10.0456 6.70236 8.76378 4.97045 10.7791 13.3504 numMergedOcc 0
57 mol 100 unq 2 iso 1 dist 6.56369 9.30209 6.39938 8.76378 4.97045 10.7791 8.30845 10.0456 6.70236 13.3504 numMergedOcc 0
58 mol 100 unq 2 iso 2 dist 9.30209 6.56369 6.39938 8.30845 6.70236 10.0456 8.76378 10.7791 4.97045 13.3504 numMergedOcc 0
59 mol 100 unq 2 iso 3 dist 9.30209 6.56369 6.39938 8.76378 10.7791 4.97045 8.30845 6.70236 10.0456 13.3504 numMergedOcc 0
60 mol 129 unq 0 iso 0 dist 9.61051 5.83384 9.05135 6.28565 6.30169 4.55551 7.58957 5.68211 10.5488 7.91034 numMergedOcc 0
61 mol 129 unq 0 iso 1 dist 9.61051 5.83384 9.05135 7.58957 5.68211 10.5488 6.28565 6.30169 4.55551 7.91034 numMergedOcc 0
62 mol 129 unq 0 iso 2 dist 5.83384 9.61051 9.05135 6.28565 4.55551 6.30169 7.58957 10.5488 5.68211 7.91034 numMergedOcc 0
63 mol 129 unq 0 iso 3 dist 5.83384 9.61051 9.05135 7.58957 10.5488 5.68211 6.28565 4.55551 6.30169 7.91034 numMergedOcc 0
64 mol 156 unq 0 iso 0 dist 8.34702 9.06726 6.31306 7.30357 10.4977 12.3086 8.61587 12.4274 10.9151 6.12113 numMergedOcc 0
65 mol 156 unq 0 iso 1 dist 8.34702 9.06726 6.31306 8.61587 12.4274 10.9151 7.30357 10.4977 12.3086 6.12113 numMergedOcc 0
66 mol 156 unq 0 iso 2 dist 9.06726 8.34702 6.31306 7.30357 12.3086 10.4977 8.61587 10.9151 12.4274 6.12113 numMergedOcc 0
67 mol 156 unq 0 iso 3 dist 9.06726 8.34702 6.31306 8.61587 10.9151 12.4274 7.30357 12.3086 10.4977 6.12113 numMergedOcc 0
68 mol 156 unq 1 iso 0 dist 8.34702 8.33171 6.56229 7.30357 10.4977 7.79535 8.61587 12.4274 6.98125 6.12113 numMergedOcc 0
69 mol 156 unq 1 iso 1 dist 8.34702 8.33171 6.56229 8.61587 12.4274 6.98125 7.30357 10.4977 7.79535 6.12113 numMergedOcc 0
70 mol 156 unq 1 iso 2 dist 8.33171 8.34702 6.56229 7.30357 7.79535 10.4977 8.61587 6.98125 12.4274 6.12113 numMergedOcc 0
71 mol 156 unq 1 iso 3 dist 8.33171 8.34702 6.56229 8.61587 6.98125 12.4274 7.30357 7.79535 10.4977 6.12113 numMergedOcc 0
72 mol 156 unq 1 iso 0 dist 9.06726 8.33171 5.64555 7.30357 12.3086 7.79535 8.61587 10.9151 6.98125 6.12113 numMergedOcc 0
73 mol 156 unq 1 iso 1 dist 9.06726 8.33171 5.64555 8.61587 10.9151 6.98125 7.30357 12.3086 7.79535 6.12113 numMergedOcc 0
74 mol 156 unq 1 iso 2 dist 8.33171 9.06726 5.64555 7.30357 7.79535 12.3086 8.61587 6.98125 10.9151 6.12113 numMergedOcc 0
75 mol 156 unq 1 iso 3 dist 8.33171 9.06726 5.64555 8.61587 6.98125 10.9151 7.30357 7.79535 12.3086 6.12113 numMergedOcc 0
76 mol 181 unq 0 iso 0 dist 5.98885 9.09537 10.1912 9.72611 5.6044 12.9468 7.99195 6.6251 10.09 12.1167 numMergedOcc 0
77 mol 181 unq 0 iso 1 dist 5.98885 9.09537 10.1912 7.99195 6.6251 10.09 9.72611 5.6044 12.9468 12.1167 numMergedOcc 0
78 mol 181 unq 0 iso 2 dist 9.09537 5.98885 10.1912 9.72611 12.9468 5.6044 7.99195 10.09 6.6251 12.1167 numMergedOcc 0
79 mol 181 unq 0 iso 3 dist 9.09537 5.98885 10.1912 7.99195 10.09 6.6251 9.72611 12.9468 5.6044 12.1167 numMergedOcc 0
80 mol 222 unq 0 iso 0 dist 8.01589 7.7699 10.4579 7.67576 10.3151 7.81022 9.82371 8.52017 15.7504 11.3283 numMergedOcc 0
81 mol 222 unq 0 iso 1 dist 8.01589 7.7699 10.4579 9.82371 8.52017 15.7504 7.67576 10.3151 7.81022 11.3283 numMergedOcc 0
82 mol 222 unq 0 iso 2 dist 7.7699 8.01589 10.4579 7.67576 7.81022 10.3151 9.82371 15.7504 8.52017 11.3283 numMergedOcc 0
83 mol 222 unq 0 iso 3 dist 7.7699 8.01589 10.4579 9.82371 15.7504 8.52017 7.67576 7.81022 10.3151 11.3283 numMergedOcc 0
84 mol 222 unq 1 iso 0 dist 8.01589 7.21333 13.3522 7.67576 10.3151 7.75656 9.82371 8.52017 16.0949 11.3283 numMergedOcc 0
85 mol 222 unq 1 iso 1 dist 8.01589 7.21333 13.3522 9.82371 8.52017 16.0949 7.67576 10.3151 7.75656 11.3283 numMergedOcc 0
86 mol 222 unq 1 iso 2 dist 7.21333 8.01589 13.3522 7.67576 7.75656 10.3151 9.82371 16.0949 8.52017 11.3283 numMergedOcc 0
87 mol 222 unq 1 iso 3 dist 7.21333 8.01589 13.3522 9.82371 16.0949 8.52017 7.67576 7.75656 10.3151 11.3283 numMergedOcc 0
88 mol 222 unq 1 iso 0 dist 7.7699 7.21333 5.24516 7.67576 7.81022 7.75656 9.82371 15.7504 16.0949 11.3283 numMergedOcc 0
89 mol 222 unq 1 iso 1 dist 7.7699 7.21333 5.24516 9.82371 15.7504 16.0949 7.67576 7.81022 7.75656 11.3283 numMergedOcc 0
90 mol 222 unq 1 iso 2 dist 7.21333 7.7699 5.24516 7.67576 7.75656 7.81022 9.82371 16.0949 15.7504 11.3283 numMergedOcc 0
91 mol 222 unq 1 iso 3 dist 7.21333 7.7699 5.24516 9.82371 16.0949 15.7504 7.67576 7.75656 7.81022 11.3283 numMergedOcc 0
92 mol 227 unq 0 iso 0 dist 9.34734 7.22101 6.99063 7.43071 6.00424 6.35849 5.41321 10.7656 10.9607 11.362 numMergedOcc 0
93 mol 227 unq 0 iso 1 dist 9.34734 7.22101 6.99063 5.41321 10.7656 10.9607 7.43071 6.00424 6.35849 11.362 numMergedOcc 0
94 mol 227 unq 0 iso 2 dist 7.22101 9.34734 6.99063 7.43071 6.35849 6.00424 5.41321 10.9607 10.7656 11.362 numMergedOcc 0
95 mol 227 unq 0 iso 3 dist 7.22101 9.34734 6.99063 5.41321 10.9607 10.7656 7.43071 6.35849 6.00424 11.362 numMergedOcc 0
96 mol 227 unq 1 iso 0 dist 9.34734 8.65997 7.60506 7.43071 6.00424 10.204 5.41321 10.7656 9.72615 11.362 numMergedOcc 0
97 mol 227 unq 1 iso 1 dist 9.34734 8.65997 7.60506 5.41321 10.7656 9.72615 7.43071 6.00424 10.204 11.362 numMergedOcc 0
98 mol 227 unq 1 iso 2 dist 8.65997 9.34734 7.60506 7.43071 10.204 6.00424 5.41321 9.72615 10.7656 11.362 numMergedOcc 0
99 mol 227 unq 1 iso 3 dist 8.65997 9.34734 7.60506 5.41321 9.72615 10.7656 7.43071 10.204 6.00424 11.362 numMergedOcc 0
100 mol 227 unq 2 iso 0 dist 9.34734 7.56888 7.43198 7.43071 6.00424 9.76735 5.41321 10.7656 5.10635 11.362 numMergedOcc 0
101 mol 227 unq 2 iso 1 dist 9.34734 7.56888 7.43198 5.41321 10.7656 5.10635 7.43071 6.00424 9.76735 11.362 numMergedOcc 0
102 mol 227 unq 2 iso 2 dist 7.56888 9.34734 7.43198 7.43071 9.76735 6.00424 5.41321 5.10635 10.7656 11.362 numMergedOcc 0
103 mol 227 unq 2 iso 3 dist 7.56888 9.34734 7.43198 5.41321 5.10635 10.7656 7.43071 9.76735 6.00424 11.362 numMergedOcc 0
104 mol 227 unq 3 iso 0 dist 9.34734 7.55216 9.51866 7.43071 6.00424 9.32448 5.41321 10.7656 6.48027 11.362 numMergedOcc 0
105 mol 227 unq 3 iso 1 dist 9.34734 7.55216 9.51866 5.41321 10.7656 6.48027 7.43071 6.00424 9.32448 11.362 numMergedOcc 0
106 mol 227 unq 3 iso 2 dist 7.55216 9.34734 9.51866 7.43071 9.32448 6.00424 5.41321 6.48027 10.7656 11.362 numMergedOcc 0
107 mol 227 unq 3 iso 3 dist 7.55216 9.34734 9.51866 5.41321 6.48027 10.7656 7.43071 9.32448 6.00424 11.362 numMergedOcc 0
108 mol 227 unq 1 iso 0 dist 7.22101 8.65997 5.22356 7.43071 6.35849 10.204 5.41321 10.9607 9.72615 11.362 numMergedOcc 0
109 mol 227 unq 1 iso 1 dist 7.22101 8.65997 5.22356 5.41321 10.9607 9.72615 7.43071 6.35849 10.204 11.362 numMergedOcc 0
110 mol 227 unq 1 iso 2 dist 8.65997 7.22101 5.22356 7.43071 10.204 6.35849 5.41321 9.72615 10.9607 11.362 numMergedOcc 0
111 mol 227 unq 1 iso 3 dist 8.65997 7.22101 5.22356 5.41321 9.72615 10.9607 7.43071 10.204 6.35849 11.362 numMergedOcc 0
112 mol 227 unq 2 iso 0 dist 7.22101 7.56888 10.8658 7.43071 6.35849 9.76735 5.41321 10.9607 5.10635 11.362 numMergedOcc 0
113 mol 227 unq 2 iso 1 dist 7.22101 7.56888 10.8658 5.41321 10.9607 5.10635 7.43071 6.35849 9.76735 11.362 numMergedOcc 0
114 mol 227 unq 2 iso 2 dist 7.56888 7.22101 10.8658 7.43071 9.76735 6.35849 5.41321 5.10635 10.9607 11.362 numMergedOcc 0
115 mol 227 unq 2 iso 3 dist 7.56888 7.22101 10.8658 5.41321 5.10635 10.9607 7.43071 9.76735 6.35849 11.362 numMergedOcc 0
116 mol 227 unq 3 iso 0 dist 7.22101 7.55216 12.4689 7.43071 6.35849 9.32448 5.41321 10.9607 6.48027 11.362 numMergedOcc 0
117 mol 227 unq 3 iso 1 dist 7.22101 7.55216 12.4689 5.41321 10.9607 6.48027 7.43071 6.35849 9.32448 11.362 numMergedOcc 0
118 mol 227 unq 3 iso 2 dist 7.55216 7.22101 12.4689 7.43071 9.32448 6.35849 5.41321 6.48027 10.9607 11.362 numMergedOcc 0
119 mol 227 unq 3 iso 3 dist 7.55216 7.22101 12.4689 5.41321 6.48027 10.9607 7.43071 9.32448 6.35849 11.362 numMergedOcc 0
120 mol 227 unq 2 iso 0 dist 8.65997 7.56888 9.70012 7.43071 10.204 9.76735 5.41321 9.72615 5.10635 11.362 numMergedOcc 0
121 mol 227 unq 2 iso 1 dist 8.65997 7.56888 9.70012 5.41321 9.72615 5.10635 7.43071 10.204 9.76735 11.362 numMergedOcc 0
122 mol 227 unq 2 iso 2 dist 7.56888 8.65997 9.70012 7.43071 9.76735 10.204 5.41321 5.10635 9.72615 11.362 numMergedOcc 0
123 mol 227 unq 2 iso 3 dist 7.56888 8.65997 9.70012 5.41321 5.10635 9.72615 7.43071 9.76735 10.204 11.362 numMergedOcc 0
124 mol 227 unq 3 iso 0 dist 8.65997 7.55216 12.9332 7.43071 10.204 9.32448 5.41321 9.72615 6.48027 11.362 numMergedOcc 0
125 mol 227 unq 3 iso 1 dist 8.65997 7.55216 12.9332 5.41321 9.72615 6.48027 7.43071 10.204 9.32448 11.362 numMergedOcc 0
126 mol 227 unq 3 iso 2 dist 7.55216 8.65997 12.9332 7.43071 9.32448 10.204 5.41321 6.48027 9.72615 11.362 numMergedOcc 0
127 mol 227 unq 3 iso 3 dist 7.55216 8.65997 12.9332 5.41321 6.48027 9.72615 7.43071 9.32448 10.204 11.362 numMergedOcc 0
128 mol 227 unq 3 iso 0 dist 7.56888 7.55216 4.48529 7.43071 9.76735 9.32448 5.41321 5.10635 6.48027 11.362 numMergedOcc 0
129 mol 227 unq 3 iso 1 dist 7.56888 7.55216 4.48529 5.41321 5.10635 6.48027 7.43071 9.76735 9.32448 11.362 numMergedOcc 0
130 mol 227 unq 3 iso 2 dist 7.55216 7.56888 4.48529 7.43071 9.32448 9.76735 5.41321 6.48027 5.10635 11.362 numMergedOcc 0
131 mol 227 unq 3 iso 3 dist 7.55216 7.56888 4.48529 5.41321 6.48027 5.10635 7.43071 9.32448 9.76735 11.362 numMergedOcc 0
132 mol 234 unq 0 iso 0 dist 8.41436 8.92474 8.62358 6.30154 7.44558 10.9712 7.32499 10.7902 4.4288 10.0708 numMergedOcc 0
133 mol 234 unq 0 iso 1 dist 8.41436 8.92474 8.62358 7.32499 10.7902 4.4288 6.30154 7.44558 10.9712 10.0708 numMergedOcc 0
134 mol 234 unq 0 iso 2 dist 8.92474 8.41436 8.62358 6.30154 10.9712 7.44558 7.32499 4.4288 10.7902 10.0708 numMergedOcc 0
135 mol 234 unq 0 iso 3 dist 8.92474 8.41436 8.62358 7.32499 4.4288 10.7902 6.30154 10.9712 7.44558 10.0708 numMergedOcc 0
