0 mol 11 unq 0 iso 0 dist 5.95165 3.77561 4.61088 4.46394 5.96346 6.86684 6.50001 4.10106 6.54358 6.859 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.36377 4.78943 5.05803 5.96976 6.93532 5.30082 9.30877 5.01101 6.42835 5.94982 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 6.36377 5.48395 6.31718 5.96976 6.93532 10.4366 9.30877 5.01101 11.0298 5.94982 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 9.54519 13.2653 5.54419 12.1061 8.4051 5.11617 16.6394 10.1698 5.68215 6.61696 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 9.54519 13.2653 5.54419 12.1061 8.4051 5.11617 13.8227 13.6174 10.9113 5.80953 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 9.54519 13.2653 5.54419 6.53276 8.23446 13.1779 13.5933 5.73029 9.16003 9.33304 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 9.54519 13.2653 5.54419 6.53276 8.23446 13.1779 9.49646 6.28159 10.4135 4.5711 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 9.54519 13.2653 5.54419 6.53276 8.23446 13.1779 6.36381 5.50396 9.33482 4.44526 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 9.54519 13.2653 5.54419 6.81998 8.75662 10.8238 6.36381 5.50396 9.33482 9.586 numMergedOcc 0
9 mol 24 unq 6 iso 0 dist 9.54519 5.80023 7.36323 12.1061 8.4051 13.2229 16.6394 10.1698 17.003 6.61696 numMergedOcc 0
10 mol 24 unq 7 iso 0 dist 9.54519 5.80023 7.36323 12.1061 8.4051 13.2229 13.8227 13.6174 16.707 5.80953 numMergedOcc 0
11 mol 24 unq 8 iso 0 dist 9.54519 5.80023 7.36323 6.53276 8.23446 6.38336 13.5933 5.73029 10.502 9.33304 numMergedOcc 0
12 mol 24 unq 9 iso 0 dist 9.54519 5.80023 7.36323 6.53276 8.23446 6.38336 9.49646 6.28159 8.87744 4.5711 numMergedOcc 0
13 mol 24 unq 10 iso 0 dist 9.54519 5.80023 7.36323 6.53276 8.23446 6.38336 6.36381 5.50396 7.27472 4.44526 numMergedOcc 0
14 mol 24 unq 11 iso 0 dist 9.54519 5.80023 7.36323 6.81998 8.75662 6.7828 6.36381 5.50396 7.27472 9.586 numMergedOcc 0
15 mol 24 unq 12 iso 0 dist 6.11056 10.4744 8.86116 11.095 8.60554 8.52463 17.6238 14.8647 12.5088 6.61696 numMergedOcc 0
16 mol 24 unq 13 iso 0 dist 6.11056 10.4744 8.86116 11.095 8.60554 8.52463 10.4056 5.11636 7.95042 5.80953 numMergedOcc 0
17 mol 24 unq 14 iso 0 dist 6.11056 10.4744 8.86116 4.04757 8.44664 10.971 8.94703 4.79736 12.3058 9.98592 numMergedOcc 0
18 mol 24 unq 15 iso 0 dist 6.11056 10.4744 8.86116 6.66757 9.44691 13.4893 15.2305 14.4081 17.9275 9.586 numMergedOcc 0
19 mol 24 unq 16 iso 0 dist 6.11056 6.9756 8.38394 11.095 8.60554 12.3994 17.6238 14.8647 17.9146 6.61696 numMergedOcc 0
20 mol 24 unq 17 iso 0 dist 6.11056 6.9756 8.38394 11.095 8.60554 12.3994 10.4056 5.11636 10.9819 5.80953 numMergedOcc 0
21 mol 24 unq 18 iso 0 dist 6.11056 6.9756 8.38394 4.04757 8.44664 5.30734 8.94703 4.79736 10.6772 9.98592 numMergedOcc 0
22 mol 24 unq 19 iso 0 dist 6.11056 6.9756 8.38394 6.66757 9.44691 12.505 15.2305 14.4081 19.8965 9.586 numMergedOcc 0
23 mol 25 unq 0 iso 0 dist 8.40051 13.466 7.57578 4.32173 6.16347 9.34396 5.77745 5.63212 10.9703 5.20109 numMergedOcc 0
24 mol 25 unq 1 iso 0 dist 8.40051 14.4191 7.17969 4.32173 6.16347 10.8498 5.77745 5.63212 10.3338 5.20109 numMergedOcc 0
25 mol 25 unq 2 iso 0 dist 8.6396 5.8503 5.04899 4.32173 7.45383 7.33728 5.77745 6.47509 7.05196 5.20109 numMergedOcc 0
26 mol 25 unq 3 iso 0 dist 8.88413 5.59268 7.17969 10.7087 7.55264 6.08585 16.4805 14.9982 11.037 9.16515 numMergedOcc 0
27 mol 25 unq 4 iso 0 dist 8.88413 5.59268 7.17969 10.7087 7.55264 6.08585 18.5622 14.1251 13.0315 9.82987 numMergedOcc 0
28 mol 25 unq 5 iso 0 dist 8.88413 5.59268 7.17969 10.7087 7.55264 6.08585 16.1203 8.41421 11.971 9.40732 numMergedOcc 0
29 mol 25 unq 6 iso 0 dist 8.88413 5.59268 7.17969 10.7087 7.55264 6.08585 13.4236 5.68041 9.48085 6.53269 numMergedOcc 0
30 mol 25 unq 7 iso 0 dist 7.63928 6.17631 6.03987 9.78075 6.85556 5.68392 12.3312 5.86705 7.6114 6.29797 numMergedOcc 0
31 mol 41 unq 0 iso 0 dist 5.41493 5.09229 6.19529 4.08339 8.51663 8.94326 9.74532 13.4019 13.8177 6.21128 numMergedOcc 0
32 mol 58 unq 0 iso 0 dist 6.36193 5.40367 6.62496 4.37642 5.93884 5.78774 8.85156 4.23671 10.2845 9.53438 numMergedOcc 0
33 mol 58 unq 1 iso 0 dist 4.88613 5.40367 6.35756 4.37642 7.68678 5.78774 8.85156 5.6823 10.2845 9.53438 numMergedOcc 0
34 mol 61 unq 0 iso 0 dist 9.22002 6.16737 6.65721 12.7481 9.25641 13.5488 15.9231 8.89519 15.4215 8.60069 numMergedOcc 0
35 mol 98 unq 0 iso 0 dist 5.9747 4.75138 5.08437 7.43001 6.65501 4.4057 14.2657 10.4782 9.81956 8.46823 numMergedOcc 0
36 mol 98 unq 1 iso 0 dist 5.9747 4.75138 5.08437 7.43001 6.65501 4.4057 8.3505 3.9764 5.10496 4.62494 numMergedOcc 0
37 mol 98 unq 2 iso 0 dist 5.9747 10.4417 6.48948 7.43001 6.65501 7.42446 14.2657 10.4782 10.8223 8.46823 numMergedOcc 0
38 mol 98 unq 3 iso 0 dist 5.9747 10.4417 6.48948 7.43001 6.65501 7.42446 8.3505 3.9764 5.92242 4.62494 numMergedOcc 0
39 mol 98 unq 4 iso 0 dist 5.9747 11.3628 6.10456 7.43001 6.65501 9.67482 14.2657 10.4782 7.54889 8.46823 numMergedOcc 0
40 mol 98 unq 5 iso 0 dist 5.9747 11.3628 6.10456 7.43001 6.65501 9.67482 8.3505 3.9764 5.2571 4.62494 numMergedOcc 0
41 mol 98 unq 6 iso 0 dist 4.50572 6.88489 5.08437 9.5305 6.65501 4.4057 14.7607 10.4782 9.81956 8.46823 numMergedOcc 0
42 mol 98 unq 7 iso 0 dist 4.50572 6.88489 5.08437 9.5305 6.65501 4.4057 8.32269 3.9764 5.10496 4.62494 numMergedOcc 0
43 mol 98 unq 8 iso 0 dist 4.50572 9.63267 6.48948 9.5305 6.65501 7.42446 14.7607 10.4782 10.8223 8.46823 numMergedOcc 0
44 mol 98 unq 9 iso 0 dist 4.50572 9.63267 6.48948 9.5305 6.65501 7.42446 8.32269 3.9764 5.92242 4.62494 numMergedOcc 0
45 mol 98 unq 10 iso 0 dist 4.50572 9.82583 6.10456 9.5305 6.65501 9.67482 14.7607 10.4782 7.54889 8.46823 numMergedOcc 0
46 mol 98 unq 11 iso 0 dist 4.50572 9.82583 6.10456 9.5305 6.65501 9.67482 8.32269 3.9764 5.2571 4.62494 numMergedOcc 0
47 mol 109 unq 0 iso 0 dist 8.3164 11.5656 8.69985 4.81814 7.80523 7.74599 9.94704 5.00433 8.52024 7.56755 numMergedOcc 0
48 mol 113 unq 0 iso 0 dist 8.89481 4.36935 5.86073 11.2266 8.8822 10.1816 18.4602 13.9729 15.7535 9.30645 numMergedOcc 0
49 mol 119 unq 0 iso 0 dist 6.18763 5.3154 6.18601 6.49348 8.00003 10.4376 9.10803 9.85023 13.6983 6.18678 numMergedOcc 0
50 mol 129 unq 0 iso 0 dist 6.38163 8.61575 9.61051 4.92611 7.58957 5.68211 6.53559 6.28232 11.3039 6.34626 numMergedOcc 0
51 mol 129 unq 1 iso 0 dist 6.38163 10.0961 5.83384 4.92611 7.58957 10.5488 6.53559 6.28232 11.7541 6.34626 numMergedOcc 0
52 mol 143 unq 0 iso 0 dist 8.30654 11.3469 5.99315 11.6678 7.78652 6.48978 12.027 4.78563 5.37047 5.06564 numMergedOcc 0
53 mol 143 unq 1 iso 0 dist 8.30654 11.3469 5.99315 11.347 8.91301 5.20762 12.027 4.78563 5.37047 7.5373 numMergedOcc 0
54 mol 181 unq 0 iso 0 dist 9.84952 4.3158 7.81386 6.78739 5.94469 7.77758 11.2091 5.42158 9.81178 8.06308 numMergedOcc 0
55 mol 181 unq 1 iso 0 dist 9.84952 12.9554 7.63312 6.78739 5.94469 12.5387 11.2091 5.42158 10.6106 8.06308 numMergedOcc 0
56 mol 222 unq 0 iso 0 dist 9.55777 6.54251 8.01589 12.979 7.67576 10.3151 15.2698 6.84862 14.4477 8.43195 numMergedOcc 0
57 mol 222 unq 1 iso 0 dist 9.55777 6.54251 8.01589 12.979 7.67576 10.3151 16.9252 9.53117 16.3082 8.23406 numMergedOcc 0
58 mol 222 unq 2 iso 0 dist 9.55777 15.3892 7.7699 12.979 7.67576 7.81022 15.2698 6.84862 10.0233 8.43195 numMergedOcc 0
59 mol 222 unq 3 iso 0 dist 9.55777 15.3892 7.7699 12.979 7.67576 7.81022 16.9252 9.53117 11.839 8.23406 numMergedOcc 0
60 mol 222 unq 4 iso 0 dist 9.55777 16.4881 7.21333 12.979 7.67576 7.75656 15.2698 6.84862 5.56538 8.43195 numMergedOcc 0
61 mol 222 unq 5 iso 0 dist 9.55777 16.4881 7.21333 12.979 7.67576 7.75656 16.9252 9.53117 7.48954 8.23406 numMergedOcc 0
62 mol 227 unq 0 iso 0 dist 9.07872 9.9474 7.09863 4.21811 6.02296 6.35849 13.0848 5.83175 5.23634 9.18728 numMergedOcc 0
63 mol 232 unq 0 iso 0 dist 9.29752 9.60401 8.27212 6.36084 9.40808 4.9377 12.6048 5.10213 6.71524 9.9183 numMergedOcc 0
64 mol 234 unq 0 iso 0 dist 7.46434 13.0285 8.41436 11.1213 7.32499 10.7902 12.6209 13.1872 17.3846 7.77911 numMergedOcc 0
65 mol 234 unq 1 iso 0 dist 7.46434 13.9912 8.92474 11.1213 7.32499 4.4288 12.6209 13.1872 11.3419 7.77911 numMergedOcc 0
66 mol 234 unq 2 iso 0 dist 7.50424 6.88707 8.41436 10.6488 7.32499 10.7902 18.3012 13.1872 17.3846 7.77911 numMergedOcc 0
67 mol 234 unq 3 iso 0 dist 7.50424 8.96936 8.92474 10.6488 7.32499 4.4288 18.3012 13.1872 11.3419 7.77911 numMergedOcc 0
68 mol 274 unq 0 iso 0 dist 9.71801 5.9882 7.56915 4.36131 8.52587 5.29529 9.39896 16.9539 12.8334 8.60027 numMergedOcc 0
