0 mol 26 unq 0 iso 0 dist 9.10253 16.9524 9.16962 18.0965 11.887 8.34347 21.6514 15.0652 7.23546 6.73162 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 7.62709 8.60899 9.20119 12.2143 6.89191 7.58835 10.82 8.59109 5.67689 6.34173 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 7.37607 10.6897 6.71911 10.4837 5.33688 7.71095 6.13182 6.5096 5.3525 8.24062 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 6.87582 7.12329 6.99777 12.5786 10.8292 6.11741 6.26739 9.9411 4.61908 9.66954 numMergedOcc 0
4 mol 115 unq 1 iso 0 dist 6.87582 7.12329 6.99777 12.5786 10.8292 6.11741 17.4177 17.3282 10.8939 7.64585 numMergedOcc 0
5 mol 115 unq 2 iso 0 dist 6.87582 7.12329 6.99777 9.93482 11.7126 7.88312 6.26739 9.9411 4.61908 8.66155 numMergedOcc 0
6 mol 115 unq 3 iso 0 dist 8.77794 5.19652 6.99777 8.97043 10.8292 6.11741 7.266 9.9411 4.61908 9.66954 numMergedOcc 0
7 mol 115 unq 4 iso 0 dist 8.77794 5.19652 6.99777 8.97043 10.8292 6.11741 11.6637 17.3282 10.8939 7.64585 numMergedOcc 0
8 mol 115 unq 5 iso 0 dist 8.77794 5.19652 6.99777 12.9647 11.7126 7.88312 7.266 9.9411 4.61908 8.66155 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 9.40225 5.66289 6.27641 9.19499 7.29758 7.44554 11.9162 6.90155 6.29785 9.36805 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 9.40225 5.66289 6.27641 13.581 4.53931 9.83699 11.9162 6.90155 6.29785 7.55203 numMergedOcc 0
11 mol 156 unq 2 iso 0 dist 7.49255 5.69897 6.27641 12.0499 7.29758 7.44554 9.42317 6.90155 6.29785 9.36805 numMergedOcc 0
12 mol 156 unq 3 iso 0 dist 7.49255 5.69897 6.27641 11.7321 4.53931 9.83699 9.42317 6.90155 6.29785 7.55203 numMergedOcc 0
13 mol 156 unq 4 iso 0 dist 4.94012 4.68187 6.27641 10.0213 7.29758 7.44554 4.71629 6.90155 6.29785 9.36805 numMergedOcc 0
14 mol 156 unq 5 iso 0 dist 4.94012 4.68187 6.27641 7.98018 4.53931 9.83699 4.71629 6.90155 6.29785 7.55203 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 9.15536 10.5343 9.31887 17.5589 11.0415 9.0018 10.9709 4.79852 8.22779 9.8589 numMergedOcc 0
16 mol 175 unq 1 iso 0 dist 9.15536 10.5343 9.31887 11.5905 5.0384 7.652 10.9709 4.79852 8.22779 7.24908 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 7.88787 10.2898 9.6668 14.2552 8.25067 9.15386 9.91634 8.20656 6.80228 6.94688 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 7.88787 10.2898 9.6668 14.2552 8.25067 9.15386 13.2318 9.40622 11.6919 6.71012 numMergedOcc 0
19 mol 181 unq 2 iso 0 dist 9.30874 5.114 6.94688 10.3907 5.86342 5.98885 7.55781 10.5561 5.4601 7.20046 numMergedOcc 0
20 mol 181 unq 3 iso 0 dist 9.30874 5.114 6.94688 10.3907 5.86342 5.98885 12.8388 11.7007 10.0524 7.13543 numMergedOcc 0
21 mol 181 unq 4 iso 0 dist 9.30874 5.114 6.94688 13.7299 6.80228 9.15386 10.168 8.20656 8.25067 9.6668 numMergedOcc 0
22 mol 181 unq 5 iso 0 dist 5.54873 5.114 6.71012 10.3907 9.14057 5.98885 7.55781 9.94131 5.4601 7.20046 numMergedOcc 0
23 mol 181 unq 6 iso 0 dist 5.54873 5.114 6.71012 10.3907 9.14057 5.98885 12.8388 12.8673 10.0524 7.13543 numMergedOcc 0
24 mol 181 unq 7 iso 0 dist 5.54873 5.114 6.71012 13.7299 11.6919 9.15386 10.168 9.40622 8.25067 9.6668 numMergedOcc 0
25 mol 181 unq 8 iso 0 dist 9.7281 7.07865 7.37327 9.79901 11.1462 7.81386 6.09218 11.691 6.7991 4.93785 numMergedOcc 0
26 mol 181 unq 9 iso 0 dist 9.7281 7.07865 7.37327 13.7928 13.3389 7.63312 10.4024 11.1129 4.80231 6.93764 numMergedOcc 0
27 mol 214 unq 0 iso 0 dist 5.77917 7.05305 7.46831 11.3827 6.67959 8.85478 14.3767 11.7443 8.47007 6.97182 numMergedOcc 0
28 mol 214 unq 1 iso 0 dist 5.77917 7.05305 7.46831 11.3827 6.67959 8.85478 17.0269 12.7646 12.8334 6.1175 numMergedOcc 0
29 mol 224 unq 0 iso 0 dist 9.97425 11.8217 7.06793 7.07564 9.36098 8.95269 4.92261 8.89778 7.98696 6.87664 numMergedOcc 0
30 mol 224 unq 1 iso 0 dist 8.39753 11.9904 7.06793 10.9817 9.36098 8.95269 6.78064 8.89778 7.98696 6.87664 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 5.72415 6.53984 6.91569 12.6391 10.9761 6.57393 11.121 11.9092 6.20606 5.38637 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 8.5166 9.78463 7.39747 13.742 6.26168 7.00034 10.9676 6.34801 7.04058 7.20082 numMergedOcc 0
33 mol 259 unq 0 iso 0 dist 7.88151 13.3233 6.77938 12.4498 4.99891 5.30224 17.4922 11.4462 5.31048 8.37865 numMergedOcc 0
