0 mol 24 unq 0 iso 0 dist 9.54519 6.36381 5.50396 13.2653 5.54419 9.33482 5.80023 7.36323 7.27472 12.3067 6.53276 8.23446 4.44526 13.1779 6.38336 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.54519 6.36381 5.50396 13.2653 5.54419 9.33482 5.80023 7.36323 7.27472 12.3067 6.81998 8.75662 9.586 10.8238 6.7828 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.40051 5.77745 5.63212 13.466 7.57578 10.9703 5.8503 11.9561 7.05196 15.5644 4.32173 6.16347 5.20109 9.34396 7.33728 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 8.40051 5.77745 5.63212 14.4191 7.17969 10.3338 5.8503 11.9561 7.05196 16.1048 4.32173 6.16347 5.20109 10.8498 7.33728 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.7522 9.90986 7.11305 15.0931 8.34347 14.8317 14.3129 10.2542 9.12845 12.875 14.288 11.9684 6.81793 17.4462 6.04762 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 6.4551 6.63973 6.77898 8.78063 6.97941 9.76346 9.42791 12.4242 8.23026 10.2083 13.5835 14.1196 8.77077 12.9045 6.5901 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 5.9747 8.3505 3.9764 4.75138 5.08437 5.10496 10.4417 6.48948 5.92242 9.51923 11.9783 11.3043 9.84703 7.94178 15.7178 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 5.9747 8.3505 3.9764 4.75138 5.08437 5.10496 10.4417 6.48948 5.92242 9.51923 7.43001 6.65501 4.62494 4.4057 7.42446 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 5.9747 8.3505 3.9764 4.75138 5.08437 5.10496 11.3628 6.10456 5.2571 8.40073 11.9783 11.3043 9.84703 7.94178 9.85543 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 5.9747 8.3505 3.9764 4.75138 5.08437 5.10496 11.3628 6.10456 5.2571 8.40073 7.43001 6.65501 4.62494 4.4057 9.67482 numMergedOcc 0
10 mol 98 unq 4 iso 0 dist 5.9747 8.3505 3.9764 4.75138 5.08437 5.10496 13.9599 10.1136 8.7497 10.2427 11.9783 11.3043 9.84703 7.94178 7.28361 numMergedOcc 0
11 mol 98 unq 5 iso 0 dist 5.9747 8.3505 3.9764 4.75138 5.08437 5.10496 13.9599 10.1136 8.7497 10.2427 7.43001 6.65501 4.62494 4.4057 12.0974 numMergedOcc 0
12 mol 98 unq 6 iso 0 dist 5.9747 8.3505 3.9764 10.4417 6.48948 5.92242 4.75138 5.08437 5.10496 9.51923 11.9783 11.3043 9.84703 15.7178 7.94178 numMergedOcc 0
13 mol 98 unq 7 iso 0 dist 5.9747 8.3505 3.9764 10.4417 6.48948 5.92242 4.75138 5.08437 5.10496 9.51923 7.43001 6.65501 4.62494 7.42446 4.4057 numMergedOcc 0
14 mol 98 unq 8 iso 0 dist 5.9747 8.3505 3.9764 10.4417 6.48948 5.92242 11.3628 6.10456 5.2571 9.42358 11.9783 11.3043 9.84703 15.7178 9.85543 numMergedOcc 0
15 mol 98 unq 9 iso 0 dist 5.9747 8.3505 3.9764 10.4417 6.48948 5.92242 11.3628 6.10456 5.2571 9.42358 7.43001 6.65501 4.62494 7.42446 9.67482 numMergedOcc 0
16 mol 98 unq 10 iso 0 dist 5.9747 8.3505 3.9764 10.4417 6.48948 5.92242 13.9599 10.1136 8.7497 13.9786 11.9783 11.3043 9.84703 15.7178 7.28361 numMergedOcc 0
17 mol 98 unq 11 iso 0 dist 5.9747 8.3505 3.9764 10.4417 6.48948 5.92242 13.9599 10.1136 8.7497 13.9786 7.43001 6.65501 4.62494 7.42446 12.0974 numMergedOcc 0
18 mol 98 unq 12 iso 0 dist 5.9747 8.3505 3.9764 11.3628 6.10456 5.2571 4.75138 5.08437 5.10496 8.40073 11.9783 11.3043 9.84703 9.85543 7.94178 numMergedOcc 0
19 mol 98 unq 13 iso 0 dist 5.9747 8.3505 3.9764 11.3628 6.10456 5.2571 4.75138 5.08437 5.10496 8.40073 7.43001 6.65501 4.62494 9.67482 4.4057 numMergedOcc 0
20 mol 98 unq 14 iso 0 dist 5.9747 8.3505 3.9764 11.3628 6.10456 5.2571 10.4417 6.48948 5.92242 9.42358 11.9783 11.3043 9.84703 9.85543 15.7178 numMergedOcc 0
21 mol 98 unq 15 iso 0 dist 5.9747 8.3505 3.9764 11.3628 6.10456 5.2571 10.4417 6.48948 5.92242 9.42358 7.43001 6.65501 4.62494 9.67482 7.42446 numMergedOcc 0
22 mol 98 unq 16 iso 0 dist 5.9747 8.3505 3.9764 11.3628 6.10456 5.2571 13.9599 10.1136 8.7497 5.02887 11.9783 11.3043 9.84703 9.85543 7.28361 numMergedOcc 0
23 mol 98 unq 17 iso 0 dist 5.9747 8.3505 3.9764 11.3628 6.10456 5.2571 13.9599 10.1136 8.7497 5.02887 7.43001 6.65501 4.62494 9.67482 12.0974 numMergedOcc 0
24 mol 109 unq 0 iso 0 dist 8.3164 9.94704 5.00433 11.5656 8.69985 8.52024 14.8479 13.1098 9.89083 7.15843 4.81814 7.80523 7.56755 7.74599 10.0688 numMergedOcc 0
25 mol 119 unq 0 iso 0 dist 6.18763 9.10803 9.85023 5.3154 6.18601 13.6983 12.7349 13.4378 9.77575 16.1743 6.49348 8.00003 6.18678 10.4376 6.36778 numMergedOcc 0
26 mol 119 unq 1 iso 0 dist 8.44385 9.10803 12.4829 12.1192 9.87172 20.14 12.7349 19.9505 9.77575 24.6691 6.49348 13.7362 6.18678 18.5424 6.36778 numMergedOcc 0
27 mol 119 unq 2 iso 0 dist 5.63005 9.10803 8.84069 10.5268 8.73993 16.2889 12.7349 15.7043 9.77575 20.0275 6.49348 9.77873 6.18678 15.0404 6.36778 numMergedOcc 0
28 mol 129 unq 0 iso 0 dist 6.38163 6.53559 6.28232 8.61575 9.61051 11.3039 6.43966 10.1333 5.51197 10.4792 4.92611 7.58957 6.34626 5.68211 4.92472 numMergedOcc 0
29 mol 129 unq 1 iso 0 dist 6.38163 6.53559 6.28232 10.0961 5.83384 11.7541 6.43966 10.1333 5.51197 14.6152 4.92611 7.58957 6.34626 10.5488 4.92472 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 8.39002 6.32334 7.05804 9.98893 8.95269 13.2325 6.31508 10.103 6.99769 10.9861 4.12728 11.9653 9.25617 11.1545 5.91654 numMergedOcc 0
31 mol 224 unq 1 iso 0 dist 8.39002 6.32334 7.05804 9.98893 8.95269 13.2325 6.31508 10.103 6.99769 10.9861 7.13796 14.5387 9.05276 16.8238 9.14278 numMergedOcc 0
32 mol 224 unq 2 iso 0 dist 8.39002 6.32334 7.05804 9.98893 8.95269 13.2325 5.72088 6.57273 8.79428 4.70378 4.12728 11.9653 9.25617 11.1545 7.38836 numMergedOcc 0
33 mol 224 unq 3 iso 0 dist 8.39002 6.32334 7.05804 9.98893 8.95269 13.2325 5.72088 6.57273 8.79428 4.70378 7.13796 14.5387 9.05276 16.8238 12.4832 numMergedOcc 0
34 mol 224 unq 4 iso 0 dist 8.39002 6.32334 7.05804 9.98893 8.95269 13.2325 6.51315 5.78342 6.8692 11.5372 4.12728 11.9653 9.25617 11.1545 10.6079 numMergedOcc 0
35 mol 224 unq 5 iso 0 dist 8.39002 6.32334 7.05804 9.98893 8.95269 13.2325 6.51315 5.78342 6.8692 11.5372 7.13796 14.5387 9.05276 16.8238 11.5752 numMergedOcc 0
36 mol 224 unq 6 iso 0 dist 8.39002 6.32334 7.05804 5.72088 6.57273 8.79428 6.31508 10.103 6.99769 6.77699 4.12728 11.9653 9.25617 7.38836 5.91654 numMergedOcc 0
37 mol 224 unq 7 iso 0 dist 8.39002 6.32334 7.05804 5.72088 6.57273 8.79428 6.31508 10.103 6.99769 6.77699 7.13796 14.5387 9.05276 12.4832 9.14278 numMergedOcc 0
38 mol 224 unq 8 iso 0 dist 8.39002 6.32334 7.05804 5.72088 6.57273 8.79428 6.51315 5.78342 6.8692 8.49799 4.12728 11.9653 9.25617 7.38836 10.6079 numMergedOcc 0
39 mol 224 unq 9 iso 0 dist 8.39002 6.32334 7.05804 5.72088 6.57273 8.79428 6.51315 5.78342 6.8692 8.49799 7.13796 14.5387 9.05276 12.4832 11.5752 numMergedOcc 0
40 mol 224 unq 10 iso 0 dist 8.39002 6.32334 7.05804 6.51315 5.78342 6.8692 6.31508 10.103 6.99769 11.328 4.12728 11.9653 9.25617 10.6079 5.91654 numMergedOcc 0
41 mol 224 unq 11 iso 0 dist 8.39002 6.32334 7.05804 6.51315 5.78342 6.8692 6.31508 10.103 6.99769 11.328 7.13796 14.5387 9.05276 11.5752 9.14278 numMergedOcc 0
42 mol 224 unq 12 iso 0 dist 8.39002 6.32334 7.05804 6.51315 5.78342 6.8692 5.72088 6.57273 8.79428 8.49799 4.12728 11.9653 9.25617 10.6079 7.38836 numMergedOcc 0
43 mol 224 unq 13 iso 0 dist 8.39002 6.32334 7.05804 6.51315 5.78342 6.8692 5.72088 6.57273 8.79428 8.49799 7.13796 14.5387 9.05276 11.5752 12.4832 numMergedOcc 0
44 mol 224 unq 14 iso 0 dist 8.46129 6.32334 5.76843 6.31508 6.65832 6.99769 5.72088 6.60589 8.79428 6.77699 4.12728 10.8507 9.25617 5.91654 7.38836 numMergedOcc 0
45 mol 224 unq 15 iso 0 dist 8.46129 6.32334 5.76843 6.31508 6.65832 6.99769 5.72088 6.60589 8.79428 6.77699 7.13796 13.4196 9.05276 9.14278 12.4832 numMergedOcc 0
46 mol 224 unq 16 iso 0 dist 8.46129 6.32334 5.76843 6.31508 6.65832 6.99769 6.51315 9.16166 6.8692 11.328 4.12728 10.8507 9.25617 5.91654 10.6079 numMergedOcc 0
47 mol 224 unq 17 iso 0 dist 8.46129 6.32334 5.76843 6.31508 6.65832 6.99769 6.51315 9.16166 6.8692 11.328 7.13796 13.4196 9.05276 9.14278 11.5752 numMergedOcc 0
48 mol 224 unq 18 iso 0 dist 8.46129 6.32334 5.76843 5.72088 6.60589 8.79428 6.31508 6.65832 6.99769 6.77699 4.12728 10.8507 9.25617 7.38836 5.91654 numMergedOcc 0
49 mol 224 unq 19 iso 0 dist 8.46129 6.32334 5.76843 5.72088 6.60589 8.79428 6.31508 6.65832 6.99769 6.77699 7.13796 13.4196 9.05276 12.4832 9.14278 numMergedOcc 0
50 mol 224 unq 20 iso 0 dist 8.46129 6.32334 5.76843 5.72088 6.60589 8.79428 6.51315 9.16166 6.8692 8.49799 4.12728 10.8507 9.25617 7.38836 10.6079 numMergedOcc 0
51 mol 224 unq 21 iso 0 dist 8.46129 6.32334 5.76843 5.72088 6.60589 8.79428 6.51315 9.16166 6.8692 8.49799 7.13796 13.4196 9.05276 12.4832 11.5752 numMergedOcc 0
52 mol 224 unq 22 iso 0 dist 8.46129 6.32334 5.76843 6.51315 9.16166 6.8692 6.31508 6.65832 6.99769 11.328 4.12728 10.8507 9.25617 10.6079 5.91654 numMergedOcc 0
53 mol 224 unq 23 iso 0 dist 8.46129 6.32334 5.76843 6.51315 9.16166 6.8692 6.31508 6.65832 6.99769 11.328 7.13796 13.4196 9.05276 11.5752 9.14278 numMergedOcc 0
54 mol 224 unq 24 iso 0 dist 8.46129 6.32334 5.76843 6.51315 9.16166 6.8692 5.72088 6.60589 8.79428 8.49799 4.12728 10.8507 9.25617 10.6079 7.38836 numMergedOcc 0
55 mol 224 unq 25 iso 0 dist 8.46129 6.32334 5.76843 6.51315 9.16166 6.8692 5.72088 6.60589 8.79428 8.49799 7.13796 13.4196 9.05276 11.5752 12.4832 numMergedOcc 0
56 mol 224 unq 26 iso 0 dist 9.2053 6.32334 4.54188 6.51315 5.81334 6.8692 6.31508 10.9745 6.99769 11.328 4.12728 12.9355 9.25617 10.6079 5.91654 numMergedOcc 0
57 mol 224 unq 27 iso 0 dist 9.2053 6.32334 4.54188 6.51315 5.81334 6.8692 6.31508 10.9745 6.99769 11.328 7.13796 12.8311 9.05276 11.5752 9.14278 numMergedOcc 0
58 mol 224 unq 28 iso 0 dist 9.2053 6.32334 4.54188 6.51315 5.81334 6.8692 5.72088 10.5128 8.79428 8.49799 4.12728 12.9355 9.25617 10.6079 7.38836 numMergedOcc 0
59 mol 224 unq 29 iso 0 dist 9.2053 6.32334 4.54188 6.51315 5.81334 6.8692 5.72088 10.5128 8.79428 8.49799 7.13796 12.8311 9.05276 11.5752 12.4832 numMergedOcc 0
60 mol 274 unq 0 iso 0 dist 9.71801 7.15079 11.4471 5.9882 7.56915 11.9912 4.37547 13.9359 9.30212 9.15171 9.95931 15.461 7.77765 15.2532 9.5468 numMergedOcc 0
