0 mol 61 unq 0 iso 0 dist 8.30431 6.32949 9.62468 14.1039 12.9303 8.44473 9.59947 10.7369 6.65721 11.2947 numMergedOcc 0
1 mol 61 unq 1 iso 0 dist 8.30431 6.32949 9.62468 14.1039 12.9303 8.44473 12.3891 11.5608 6.72123 4.78811 numMergedOcc 0
2 mol 61 unq 2 iso 0 dist 4.628 6.32949 5.92705 14.1039 13.2942 8.44473 9.59947 5.4671 6.65721 11.2947 numMergedOcc 0
3 mol 61 unq 3 iso 0 dist 4.628 6.32949 5.92705 14.1039 13.2942 8.44473 12.3891 10.1513 6.72123 4.78811 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 5.39171 10.5627 6.89722 13.1329 7.92924 7.23812 10.392 10.4716 9.96396 12.8453 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 5.39171 10.5627 6.89722 13.1329 7.92924 7.23812 6.30194 5.2774 6.19304 9.59988 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 5.39171 10.5627 6.89722 13.1329 7.92924 7.23812 18.5427 13.9156 8.70481 7.80518 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 9.27355 10.5627 7.26679 13.1329 5.4653 7.23812 10.392 8.31041 9.96396 12.8453 numMergedOcc 0
8 mol 73 unq 4 iso 0 dist 9.27355 10.5627 7.26679 13.1329 5.4653 7.23812 6.30194 5.44275 6.19304 9.59988 numMergedOcc 0
9 mol 73 unq 5 iso 0 dist 9.27355 10.5627 7.26679 13.1329 5.4653 7.23812 18.5427 11.2674 8.70481 7.80518 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 7.07421 4.80675 6.29026 7.6453 5.06265 8.00624 10.1938 11.5533 8.54584 15.4586 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 8.14441 13.6129 8.0974 17.5409 11.7183 9.63185 18.3231 12.2822 6.69288 14.4816 numMergedOcc 0
12 mol 178 unq 1 iso 0 dist 8.14441 13.6129 8.0974 17.5409 11.7183 9.63185 19.4581 12.4338 6.43573 10.2893 numMergedOcc 0
13 mol 178 unq 2 iso 0 dist 8.14441 13.6129 8.0974 17.5409 11.7183 9.63185 17.5964 13.9722 7.17202 9.7684 numMergedOcc 0
14 mol 178 unq 3 iso 0 dist 8.14441 13.6129 8.0974 17.5409 11.7183 9.63185 17.9703 13.5599 8.81551 5.37264 numMergedOcc 0
15 mol 210 unq 0 iso 0 dist 6.24111 13.3929 9.67457 10.7017 5.02037 6.13878 8.07523 5.82028 6.18308 5.4508 numMergedOcc 0
16 mol 210 unq 1 iso 0 dist 9.00343 12.3088 9.67457 11.9511 5.02037 6.13878 7.56882 5.82028 6.18308 5.4508 numMergedOcc 0
17 mol 210 unq 2 iso 0 dist 6.41444 13.3774 9.67457 10.3236 5.02037 6.13878 10.5902 5.82028 6.18308 5.4508 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 9.81136 17.404 8.49704 24.0171 17.1631 9.92165 18.7061 12.4611 9.65138 10.1227 numMergedOcc 0
19 mol 214 unq 1 iso 0 dist 9.81136 17.404 8.49704 24.0171 17.1631 9.92165 17.5046 11.832 7.14453 6.83063 numMergedOcc 0
20 mol 214 unq 2 iso 0 dist 9.81136 17.404 8.49704 24.0171 17.1631 9.92165 18.1374 10.644 8.85478 12.7439 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 7.57712 6.19375 7.31105 5.25149 10.1832 5.39218 15.0279 14.6296 9.23153 13.3213 numMergedOcc 0
22 mol 220 unq 1 iso 0 dist 7.57712 6.19375 7.31105 5.25149 10.1832 5.39218 13.2107 9.52692 8.24498 11.4842 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 7.62593 12.5358 7.39839 12.1554 5.8656 8.80858 14.7665 7.65225 6.65832 4.46743 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 7.62593 12.5358 7.39839 12.1554 5.8656 8.80858 9.04374 4.91322 6.60589 4.93626 numMergedOcc 0
25 mol 224 unq 2 iso 0 dist 7.62593 12.5358 7.39839 12.1554 5.8656 8.80858 15.1903 12.979 9.16166 11.8641 numMergedOcc 0
26 mol 224 unq 3 iso 0 dist 7.58998 6.87755 6.23882 6.23677 6.88745 7.49783 12.2287 15.0038 8.95269 12.8561 numMergedOcc 0
27 mol 236 unq 0 iso 0 dist 9.13126 5.52669 9.10613 4.71683 8.3795 9.44496 6.73134 6.0258 8.04248 7.41812 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 6.18866 12.5843 7.29898 16.2589 10.254 6.26142 12.4678 6.6173 7.57994 5.59015 numMergedOcc 0
29 mol 249 unq 1 iso 0 dist 6.18866 12.5843 7.29898 16.2589 10.254 6.26142 15.0782 8.95486 6.18582 4.77325 numMergedOcc 0
30 mol 249 unq 2 iso 0 dist 9.3807 12.5843 8.91685 16.2589 8.81984 6.26142 12.4678 5.25611 7.57994 5.59015 numMergedOcc 0
31 mol 249 unq 3 iso 0 dist 9.3807 12.5843 8.91685 16.2589 8.81984 6.26142 15.0782 9.66184 6.18582 4.77325 numMergedOcc 0
32 mol 258 unq 0 iso 0 dist 8.57305 6.51074 5.81927 6.33567 5.00751 7.69358 10.3219 9.49027 6.97229 9.80642 numMergedOcc 0
33 mol 258 unq 1 iso 0 dist 7.70189 9.78068 8.58088 8.10903 5.27718 9.04358 14.0712 10.221 6.60405 8.81588 numMergedOcc 0
34 mol 258 unq 2 iso 0 dist 7.70189 9.78068 8.58088 8.10903 5.27718 9.04358 8.81059 9.22664 6.42289 5.90131 numMergedOcc 0
35 mol 277 unq 0 iso 0 dist 6.23539 7.44724 6.90434 6.66936 5.95045 4.81916 14.2462 13.2927 9.7748 7.94155 numMergedOcc 0
36 mol 280 unq 0 iso 0 dist 7.3304 7.26698 8.85762 14.1864 11.4101 7.96485 8.27417 4.95798 6.0664 8.26589 numMergedOcc 0
37 mol 282 unq 0 iso 0 dist 7.93511 9.67023 5.67266 15.7481 8.78407 7.71088 14.1723 9.63727 8.04483 5.86383 numMergedOcc 0
38 mol 282 unq 1 iso 0 dist 7.93511 9.67023 5.67266 15.7481 8.78407 7.71088 6.84554 4.58403 8.76532 11.2986 numMergedOcc 0
39 mol 282 unq 2 iso 0 dist 7.93511 9.67023 5.67266 15.7481 8.78407 7.71088 9.51581 5.04235 6.33524 7.46064 numMergedOcc 0
40 mol 282 unq 3 iso 0 dist 5.62497 8.13794 9.63346 11.0423 9.73996 7.71088 8.58671 4.85461 8.04483 5.86383 numMergedOcc 0
41 mol 282 unq 4 iso 0 dist 5.62497 8.13794 9.63346 11.0423 9.73996 7.71088 14.7737 13.108 8.76532 11.2986 numMergedOcc 0
42 mol 282 unq 5 iso 0 dist 5.62497 8.13794 9.63346 11.0423 9.73996 7.71088 11.0247 8.85797 6.33524 7.46064 numMergedOcc 0
