0 mol 11 unq 0 iso 0 dist 9.07476 10.5382 9.74528 5.23547 9.89425 11.3059 9.46202 6.83186 15.0022 12.0683 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 8.76224 8.34712 7.7871 7.77448 9.2146 11.0435 11.7233 8.53424 11.1346 16.4255 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 8.76224 8.34712 7.7871 7.77448 9.2146 11.0435 13.0183 7.08766 10.8275 16.0765 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 8.76224 8.34712 7.7871 7.77448 9.2146 11.0435 10.9699 4.82199 7.90018 13.6412 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 9.54314 4.44905 6.89855 7.78684 8.78414 5.74753 9.09265 8.14512 5.04771 4.73277 numMergedOcc 0
5 mol 63 unq 1 iso 0 dist 9.54314 4.44905 6.89855 7.78684 8.78414 5.74753 7.57764 9.13228 9.54378 10.1907 numMergedOcc 0
6 mol 63 unq 2 iso 0 dist 9.54314 6.25029 7.85738 7.78684 8.78414 5.82517 9.09265 8.14512 9.28052 4.73277 numMergedOcc 0
7 mol 63 unq 3 iso 0 dist 9.54314 6.25029 7.85738 7.78684 8.78414 5.82517 7.57764 9.13228 4.44607 10.1907 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 6.46582 4.00834 5.91098 11.3491 9.57759 13.363 9.68005 7.66068 11.6853 9.50354 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 6.46582 4.00834 5.91098 11.3491 9.57759 13.363 14.6547 9.5043 15.0489 12.0331 numMergedOcc 0
10 mol 76 unq 2 iso 0 dist 6.46582 4.00834 5.91098 11.3491 9.57759 13.363 14.1202 8.34132 14.2393 9.2434 numMergedOcc 0
11 mol 76 unq 3 iso 0 dist 6.46582 9.6911 4.86523 11.3491 9.57759 7.37421 9.68005 7.66068 4.94673 9.50354 numMergedOcc 0
12 mol 76 unq 4 iso 0 dist 6.46582 9.6911 4.86523 11.3491 9.57759 7.37421 14.6547 9.5043 5.78236 12.0331 numMergedOcc 0
13 mol 76 unq 5 iso 0 dist 6.46582 9.6911 4.86523 11.3491 9.57759 7.37421 14.1202 8.34132 4.73151 9.2434 numMergedOcc 0
14 mol 78 unq 0 iso 0 dist 6.73466 6.26966 6.11101 3.44873 9.38837 7.35151 4.15443 9.07629 5.72585 4.83106 numMergedOcc 0
15 mol 78 unq 1 iso 0 dist 6.73466 6.26966 6.11101 3.44873 9.38837 7.35151 5.83035 8.61143 7.38398 4.315 numMergedOcc 0
16 mol 78 unq 2 iso 0 dist 6.73466 6.26966 6.11101 10.3854 9.80913 4.76634 4.15443 9.07629 5.72585 9.40741 numMergedOcc 0
17 mol 78 unq 3 iso 0 dist 6.73466 6.26966 6.11101 10.3854 9.80913 4.76634 5.83035 8.61143 7.38398 9.00868 numMergedOcc 0
18 mol 83 unq 0 iso 0 dist 9.94528 9.39588 7.69755 6.51558 5.35861 4.93836 5.31562 7.50925 4.12785 3.62753 numMergedOcc 0
19 mol 83 unq 1 iso 0 dist 9.94528 9.39588 7.69755 6.51558 5.35861 4.93836 9.24212 6.96722 6.83349 3.65203 numMergedOcc 0
20 mol 83 unq 2 iso 0 dist 9.94528 14.6472 9.64197 6.51558 5.35861 8.82563 5.31562 7.50925 9.58199 3.62753 numMergedOcc 0
21 mol 83 unq 3 iso 0 dist 9.94528 14.6472 9.64197 6.51558 5.35861 8.82563 9.24212 6.96722 8.6522 3.65203 numMergedOcc 0
22 mol 83 unq 4 iso 0 dist 8.94777 12.0034 7.69755 9.07479 5.35861 4.93836 8.56578 7.50925 4.12785 3.62753 numMergedOcc 0
23 mol 83 unq 5 iso 0 dist 8.94777 12.0034 7.69755 9.07479 5.35861 4.93836 12.1198 6.96722 6.83349 3.65203 numMergedOcc 0
24 mol 83 unq 6 iso 0 dist 8.94777 16.6651 9.64197 9.07479 5.35861 8.82563 8.56578 7.50925 9.58199 3.62753 numMergedOcc 0
25 mol 83 unq 7 iso 0 dist 8.94777 16.6651 9.64197 9.07479 5.35861 8.82563 12.1198 6.96722 8.6522 3.65203 numMergedOcc 0
26 mol 83 unq 8 iso 0 dist 9.47551 5.68174 7.69755 5.46512 5.35861 4.93836 7.14423 7.50925 4.12785 3.62753 numMergedOcc 0
27 mol 83 unq 9 iso 0 dist 9.47551 5.68174 7.69755 5.46512 5.35861 4.93836 3.76903 6.96722 6.83349 3.65203 numMergedOcc 0
28 mol 83 unq 10 iso 0 dist 9.47551 6.90476 9.64197 5.46512 5.35861 8.82563 7.14423 7.50925 9.58199 3.62753 numMergedOcc 0
29 mol 83 unq 11 iso 0 dist 9.47551 6.90476 9.64197 5.46512 5.35861 8.82563 3.76903 6.96722 8.6522 3.65203 numMergedOcc 0
30 mol 186 unq 0 iso 0 dist 9.14525 9.9552 4.79423 5.22626 8.92135 9.5548 13.1776 7.25595 5.86994 14.4913 numMergedOcc 0
31 mol 186 unq 1 iso 0 dist 9.14525 9.9552 4.79423 5.22626 8.92135 9.5548 4.10348 9.94825 8.74892 5.43612 numMergedOcc 0
32 mol 254 unq 0 iso 0 dist 7.89302 10.4935 9.84028 5.06168 5.6417 8.2786 5.81468 7.85841 11.4342 8.8967 numMergedOcc 0
33 mol 254 unq 1 iso 0 dist 7.89302 10.4935 9.84028 5.06168 5.6417 8.2786 8.51317 9.20109 11.2466 10.929 numMergedOcc 0
34 mol 254 unq 2 iso 0 dist 7.89302 10.4935 9.84028 6.25965 7.42831 5.20737 5.81468 7.85841 11.4342 9.42679 numMergedOcc 0
35 mol 254 unq 3 iso 0 dist 7.89302 10.4935 9.84028 6.25965 7.42831 5.20737 8.51317 9.20109 11.2466 10.706 numMergedOcc 0
36 mol 260 unq 0 iso 0 dist 9.46576 13.9264 6.90472 17.1277 9.73217 4.35925 3.48905 8.62655 11.9315 15.6308 numMergedOcc 0
37 mol 260 unq 1 iso 0 dist 9.46576 13.9264 6.90472 6.73886 7.49606 13.8859 3.48905 8.62655 11.9315 7.35802 numMergedOcc 0
38 mol 260 unq 2 iso 0 dist 9.46576 13.9264 6.90472 11.1586 8.06377 13.5662 3.48905 8.62655 11.9315 10.4054 numMergedOcc 0
39 mol 266 unq 0 iso 0 dist 9.35293 6.3565 6.48382 10.858 8.20376 7.90149 7.2339 6.96692 5.79323 3.68488 numMergedOcc 0
40 mol 266 unq 1 iso 0 dist 9.35293 6.3565 6.48382 10.858 8.20376 7.90149 12.15 8.25286 7.52317 3.14784 numMergedOcc 0
41 mol 266 unq 2 iso 0 dist 9.35293 6.3565 6.48382 10.858 8.20376 7.90149 14.8334 9.9965 9.52953 5.95721 numMergedOcc 0
42 mol 266 unq 3 iso 0 dist 7.93375 5.54798 6.48382 7.54309 8.20376 7.90149 3.87565 6.96692 5.79323 3.68488 numMergedOcc 0
43 mol 266 unq 4 iso 0 dist 7.93375 5.54798 6.48382 7.54309 8.20376 7.90149 9.25882 8.25286 7.52317 3.14784 numMergedOcc 0
44 mol 266 unq 5 iso 0 dist 7.93375 5.54798 6.48382 7.54309 8.20376 7.90149 12.1357 9.9965 9.52953 5.95721 numMergedOcc 0
