0 mol 16 unq 0 iso 0 dist 6.04965 6.20183 6.29703 5.8404 4.86568 5.64581 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.75381 5.48497 8.47315 5.50193 4.7319 5.59769 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 6.47132 10.6275 6.48625 9.86595 7.17396 6.34264 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 6.47132 10.6275 6.48625 10.2137 9.21998 5.30842 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 8.14057 11.0399 7.49054 7.39819 5.83409 5.49044 numMergedOcc 0
5 mol 94 unq 0 iso 0 dist 8.13248 9.27318 9.33801 4.83621 7.89459 5.81332 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 8.06457 4.97314 8.54906 4.165 7.88289 6.6292 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 8.06457 4.97314 8.54906 7.84998 9.01083 12.3193 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 5.79411 6.82817 9.01767 6.03768 7.36792 6.42572 numMergedOcc 0
9 mol 102 unq 1 iso 0 dist 5.79411 10.6581 9.80678 6.03768 7.36792 5.54551 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 6.3982 5.93926 6.7225 5.29965 5.11551 5.39296 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 8.98848 14.6332 9.85576 14.6144 7.90328 10.4589 numMergedOcc 0
12 mol 117 unq 1 iso 0 dist 8.98848 14.6332 9.85576 10.0436 7.83136 14.2649 numMergedOcc 0
13 mol 117 unq 2 iso 0 dist 8.98848 14.6332 9.85576 6.81312 7.0603 9.53886 numMergedOcc 0
14 mol 129 unq 0 iso 0 dist 6.1421 7.55004 6.29026 7.86921 8.54584 11.5533 numMergedOcc 0
15 mol 129 unq 1 iso 0 dist 9.54663 8.10347 6.29026 6.95124 8.54584 11.5533 numMergedOcc 0
16 mol 131 unq 0 iso 0 dist 6.44766 9.91056 8.97145 7.69184 6.85062 14.257 numMergedOcc 0
17 mol 131 unq 1 iso 0 dist 6.44766 4.56884 6.5874 7.69184 6.85062 7.60371 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 8.31743 8.14784 7.78849 10.2414 9.89303 11.454 numMergedOcc 0
19 mol 182 unq 0 iso 0 dist 7.21035 6.16006 7.86625 8.27436 9.31746 5.40949 numMergedOcc 0
20 mol 197 unq 0 iso 0 dist 9.00273 17.3985 8.64255 12.3192 8.56633 11.8861 numMergedOcc 0
21 mol 197 unq 1 iso 0 dist 7.19387 14.5201 8.64255 11.7609 8.56633 11.8861 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 9.33638 13.5629 8.49704 15.9383 9.65138 12.4611 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 9.33638 13.5629 8.49704 7.31241 7.14453 11.832 numMergedOcc 0
24 mol 214 unq 2 iso 0 dist 9.33638 13.5629 8.49704 17.0758 8.85478 10.644 numMergedOcc 0
25 mol 220 unq 0 iso 0 dist 9.05754 11.6352 7.31105 15.9524 9.23153 14.6296 numMergedOcc 0
26 mol 220 unq 1 iso 0 dist 9.05754 11.6352 7.31105 10.0641 8.24498 9.52692 numMergedOcc 0
27 mol 234 unq 0 iso 0 dist 9.5181 7.03383 8.47009 9.15708 9.36357 4.74041 numMergedOcc 0
28 mol 234 unq 1 iso 0 dist 9.5181 7.03383 8.47009 4.94699 6.7625 6.16697 numMergedOcc 0
29 mol 236 unq 0 iso 0 dist 6.67907 10.4934 9.10613 5.81354 8.04248 6.0258 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 9.94587 15.1802 9.75174 4.3284 6.57393 13.477 numMergedOcc 0
31 mol 239 unq 0 iso 0 dist 9.73858 11.2409 6.37342 7.43079 6.16342 5.29737 numMergedOcc 0
32 mol 249 unq 0 iso 0 dist 9.14351 10.0482 7.29898 12.1004 7.57994 6.6173 numMergedOcc 0
33 mol 249 unq 1 iso 0 dist 9.14351 10.0482 7.29898 9.40115 6.18582 8.95486 numMergedOcc 0
34 mol 249 unq 2 iso 0 dist 9.14351 14.5045 8.91685 12.1004 7.57994 5.25611 numMergedOcc 0
35 mol 249 unq 3 iso 0 dist 9.14351 14.5045 8.91685 9.40115 6.18582 9.66184 numMergedOcc 0
36 mol 253 unq 0 iso 0 dist 9.75753 11.2081 7.7993 15.0268 9.02271 13.0587 numMergedOcc 0
37 mol 253 unq 1 iso 0 dist 9.75753 11.7837 6.10761 15.0268 9.02271 4.70422 numMergedOcc 0
38 mol 259 unq 0 iso 0 dist 9.89728 16.8866 7.93997 5.07898 7.46176 14.8465 numMergedOcc 0
39 mol 276 unq 0 iso 0 dist 6.97104 12.6916 9.05218 12.2532 9.8993 5.72513 numMergedOcc 0
40 mol 276 unq 1 iso 0 dist 6.97104 12.6916 9.05218 5.58984 6.87396 8.86096 numMergedOcc 0
41 mol 276 unq 2 iso 0 dist 8.63281 11.5683 9.05218 12.388 9.8993 5.72513 numMergedOcc 0
42 mol 276 unq 3 iso 0 dist 8.63281 11.5683 9.05218 6.58819 6.87396 8.86096 numMergedOcc 0
43 mol 277 unq 0 iso 0 dist 6.86014 9.93994 6.90434 4.83355 9.7748 13.2927 numMergedOcc 0
44 mol 277 unq 1 iso 0 dist 5.97073 9.83255 6.90434 11.2857 9.7748 13.2927 numMergedOcc 0
45 mol 277 unq 2 iso 0 dist 6.49176 11.3539 6.90434 14.4976 9.7748 13.2927 numMergedOcc 0
46 mol 278 unq 0 iso 0 dist 8.62414 18.1946 9.82774 12.2316 8.44326 10.5903 numMergedOcc 0
47 mol 279 unq 0 iso 0 dist 9.60619 6.56932 8.13489 9.96126 9.70696 5.51096 numMergedOcc 0
