0 mol 7 unq 0 iso 0 dist 9.8603 14.6665 7.10621 15.8072 8.72114 13.8829 16.2118 7.12508 6.1206 11.2901 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.8603 14.6665 7.10621 15.8072 8.72114 13.8829 18.9985 11.143 7.67927 16.0449 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.51421 10.6104 8.41585 4.60206 5.99972 12.0193 16.4746 12.8323 9.87885 14.8356 numMergedOcc 0
3 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
4 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
5 mol 16 unq 1 iso 0 dist 6.36377 4.78943 5.05803 5.96976 6.93532 5.30082 9.8871 4.65873 6.57331 10.0132 numMergedOcc 0
6 mol 16 unq 2 iso 0 dist 6.36377 5.48395 6.31718 5.96976 6.93532 10.4366 9.8871 4.65873 8.43054 10.0132 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 9.54519 13.2653 5.54419 12.1061 8.4051 5.11617 14.1706 4.82629 6.6219 11.3231 numMergedOcc 0
8 mol 24 unq 1 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
9 mol 24 unq 2 iso 0 dist 9.54519 13.2653 5.54419 6.53276 8.23446 13.1779 14.1706 4.82629 6.6219 11.3777 numMergedOcc 0
10 mol 24 unq 3 iso 0 dist 9.54519 13.2653 5.54419 6.53276 8.23446 13.1779 16.6394 10.1698 5.68215 16.1924 numMergedOcc 0
11 mol 24 unq 4 iso 0 dist 9.54519 13.2653 5.54419 6.81998 8.75662 10.8238 14.1706 4.82629 6.6219 13.0711 numMergedOcc 0
12 mol 24 unq 5 iso 0 dist 9.54519 13.2653 5.54419 6.81998 8.75662 10.8238 16.6394 10.1698 5.68215 15.3807 numMergedOcc 0
13 mol 24 unq 6 iso 0 dist 9.54519 5.80023 7.36323 12.1061 8.4051 13.2229 9.49646 6.28159 8.87744 12.3034 numMergedOcc 0
14 mol 24 unq 7 iso 0 dist 9.54519 5.80023 7.36323 12.1061 8.4051 13.2229 6.36381 5.50396 7.27472 9.84204 numMergedOcc 0
15 mol 24 unq 8 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
16 mol 24 unq 9 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
17 mol 24 unq 10 iso 0 dist 9.54519 5.80023 7.36323 6.81998 8.75662 6.7828 9.49646 6.28159 8.87744 12.6707 numMergedOcc 0
18 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
19 mol 24 unq 12 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
20 mol 24 unq 13 iso 0 dist 6.11056 10.4744 8.86116 4.04757 8.44664 10.971 10.4056 5.11636 7.95042 12.8213 numMergedOcc 0
21 mol 24 unq 14 iso 0 dist 6.11056 10.4744 8.86116 6.66757 9.44691 13.4893 10.4056 5.11636 7.95042 11.7489 numMergedOcc 0
22 mol 25 unq 0 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
23 mol 25 unq 1 iso 0 dist 8.6396 5.8503 5.04899 16.0077 9.01548 13.9331 5.77745 6.47509 7.05196 12.506 numMergedOcc 0
24 mol 25 unq 2 iso 0 dist 8.88413 5.59268 7.17969 10.7087 7.55264 6.08585 8.27137 11.4148 4.79873 9.35791 numMergedOcc 0
25 mol 25 unq 3 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
26 mol 25 unq 4 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
27 mol 43 unq 0 iso 0 dist 8.38387 11.0096 8.80331 7.13085 8.95682 6.18002 12.266 5.41726 6.6263 10.3764 numMergedOcc 0
28 mol 43 unq 1 iso 0 dist 8.38387 11.8286 6.20293 7.13085 8.95682 8.38399 12.266 5.41726 6.75943 10.3764 numMergedOcc 0
29 mol 98 unq 0 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
30 mol 98 unq 1 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
31 mol 98 unq 2 iso 0 dist 5.9747 10.4417 6.48948 7.43001 6.65501 7.42446 7.34638 7.03983 7.02507 9.84743 numMergedOcc 0
32 mol 98 unq 3 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
33 mol 98 unq 4 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
34 mol 98 unq 5 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
35 mol 98 unq 6 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
36 mol 98 unq 7 iso 0 dist 4.50572 9.63267 6.48948 9.5305 6.65501 7.42446 6.0995 7.03983 7.02507 9.84743 numMergedOcc 0
37 mol 98 unq 8 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
38 mol 98 unq 9 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
39 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
40 mol 129 unq 0 iso 0 dist 6.38163 10.0961 5.83384 7.03404 6.28565 4.55551 14.5306 9.00231 5.58833 9.8591 numMergedOcc 0
41 mol 129 unq 1 iso 0 dist 6.38163 10.0961 5.83384 4.92611 7.58957 10.5488 14.5306 9.00231 5.58833 15.5412 numMergedOcc 0
42 mol 131 unq 0 iso 0 dist 6.31125 5.6098 8.40312 11.127 9.90168 7.7567 9.10434 3.98662 9.27976 10.0568 numMergedOcc 0
43 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
44 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
45 mol 192 unq 0 iso 0 dist 9.90531 8.43102 5.59424 11.0516 8.77999 8.49529 17.2469 9.53265 9.78634 15.7529 numMergedOcc 0
46 mol 192 unq 1 iso 0 dist 9.90531 8.43102 5.59424 11.0516 8.77999 8.49529 11.6646 6.35474 5.64942 13.3256 numMergedOcc 0
47 mol 192 unq 2 iso 0 dist 9.90531 8.43102 5.59424 11.0516 8.77999 8.49529 11.4183 5.25965 7.43054 13.7172 numMergedOcc 0
48 mol 192 unq 3 iso 0 dist 9.90531 4.96445 7.00794 11.0516 8.77999 11.7523 11.6646 6.35474 6.97962 13.3256 numMergedOcc 0
49 mol 192 unq 4 iso 0 dist 9.90531 4.96445 7.00794 11.0516 8.77999 11.7523 11.4183 5.25965 6.79229 13.7172 numMergedOcc 0
50 mol 222 unq 0 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
51 mol 222 unq 1 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
52 mol 222 unq 2 iso 0 dist 9.55777 16.4881 7.21333 4.05539 9.82371 16.0949 15.2698 6.84862 5.56538 14.0832 numMergedOcc 0
53 mol 222 unq 3 iso 0 dist 9.55777 16.4881 7.21333 4.05539 9.82371 16.0949 16.9252 9.53117 7.48954 14.9425 numMergedOcc 0
54 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
55 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
56 mol 239 unq 0 iso 0 dist 6.44212 7.97883 6.16342 8.28901 8.84636 4.30299 14.1679 10.6736 6.73665 10.0627 numMergedOcc 0
57 mol 259 unq 0 iso 0 dist 8.06771 6.64729 8.13497 5.61261 7.98231 8.41846 13.9131 8.8603 9.07743 14.6679 numMergedOcc 0
58 mol 259 unq 1 iso 0 dist 8.06771 9.79538 7.88519 5.61261 7.98231 8.81835 14.2921 7.20604 9.63573 11.547 numMergedOcc 0
59 mol 259 unq 2 iso 0 dist 8.06771 9.79538 7.88519 5.61261 7.98231 8.81835 13.9131 8.8603 7.66153 14.6679 numMergedOcc 0
60 mol 259 unq 3 iso 0 dist 9.54857 15.3806 7.46176 8.74892 7.08526 8.81835 13.6312 5.21606 9.63573 11.547 numMergedOcc 0
61 mol 259 unq 4 iso 0 dist 9.54857 15.3806 7.46176 8.74892 7.08526 8.81835 21.0823 11.8896 7.66153 14.6679 numMergedOcc 0
