0 mol 38 unq 0 iso 0 dist 5.86972 7.46414 9.23576 8.80956 7.35595 7.50293 11.0959 7.10133 8.83233 7.63536 numMergedOcc 0
1 mol 38 unq 1 iso 0 dist 5.86972 7.46414 9.23576 12.4417 8.59794 9.91611 11.0959 7.10133 8.83233 4.04384 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.27355 10.8067 9.68526 10.392 8.31041 9.38498 7.02693 8.0072 6.23522 4.73407 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.60363 10.8067 9.72442 10.392 11.7069 9.38498 7.02693 9.61302 6.23522 4.73407 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 9.27331 10.163 9.72442 15.2052 11.7069 9.38498 14.0314 9.61302 6.23522 4.73407 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 5.31281 5.24877 8.42445 9.24515 7.18757 7.5732 13.8371 13.1958 9.93438 6.25685 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 7.07421 4.80675 6.29026 10.1938 11.5533 8.54584 4.4077 6.14663 7.97548 12.5321 numMergedOcc 0
7 mol 129 unq 1 iso 0 dist 7.07421 4.80675 6.29026 10.1938 11.5533 8.54584 8.4874 5.32811 9.64164 11.3755 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 6.94435 6.34094 9.91643 11.1774 7.40242 9.28393 11.0218 11.0219 5.92733 6.00473 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.07294 13.1243 8.84018 15.4604 8.00493 6.5107 9.35049 3.75786 5.78814 6.12885 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 7.50126 15.9524 8.84018 12.9713 8.00493 6.5107 10.3668 3.75786 5.78814 6.12885 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 5.59682 6.62991 8.89982 11.2249 13.2491 8.56324 6.68265 4.19899 7.55934 9.73449 numMergedOcc 0
12 mol 152 unq 1 iso 0 dist 7.71277 7.17016 8.89982 13.9298 13.2491 8.56324 7.78842 4.19899 7.55934 9.73449 numMergedOcc 0
13 mol 152 unq 2 iso 0 dist 6.4737 7.20811 9.74498 13.03 10.7816 8.67331 9.71586 6.37913 7.55419 4.73288 numMergedOcc 0
14 mol 152 unq 3 iso 0 dist 6.4737 7.20811 9.74498 9.36082 7.26476 8.05741 9.71586 6.37913 7.55419 4.70284 numMergedOcc 0
15 mol 178 unq 0 iso 0 dist 8.14441 13.6129 8.0974 18.3231 12.2822 6.69288 18.2521 12.4011 4.72821 4.69387 numMergedOcc 0
16 mol 178 unq 1 iso 0 dist 8.14441 13.6129 8.0974 19.4581 12.4338 6.43573 18.2521 12.4011 4.72821 3.70233 numMergedOcc 0
17 mol 178 unq 2 iso 0 dist 8.14441 13.6129 8.0974 17.5964 13.9722 7.17202 18.2521 12.4011 4.72821 7.39705 numMergedOcc 0
18 mol 178 unq 3 iso 0 dist 8.14441 13.6129 8.0974 17.9703 13.5599 8.81551 18.2521 12.4011 4.72821 9.77268 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 6.24111 13.3929 9.67457 8.07523 5.82028 6.18308 11.6806 8.81074 6.85824 4.29623 numMergedOcc 0
20 mol 210 unq 1 iso 0 dist 9.00343 12.3088 9.67457 7.56882 5.82028 6.18308 11.2036 8.81074 6.85824 4.29623 numMergedOcc 0
21 mol 210 unq 2 iso 0 dist 6.41444 13.3774 9.67457 10.5902 5.82028 6.18308 14.5181 8.81074 6.85824 4.29623 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 8.57305 6.51074 5.81927 10.3219 9.49027 6.97229 10.1768 4.87461 7.12221 6.24714 numMergedOcc 0
23 mol 258 unq 1 iso 0 dist 8.57305 6.51074 5.81927 10.3219 9.49027 6.97229 10.2662 9.93118 5.4557 4.02333 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 6.23539 7.44724 6.90434 14.2462 13.2927 9.7748 10.4606 11.5613 4.9764 11.8607 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 6.23539 7.44724 6.90434 14.2462 13.2927 9.7748 13.1741 13.0566 6.36559 10.9137 numMergedOcc 0
