0 mol 33 unq 0 iso 0 dist 8.87925 9.45316 4.13966 12.3928 7.14232 11.2673 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.90024 9.92963 18.4575 14.9559 8.38387 24.2919 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.90024 8.07389 6.09486 14.9559 8.38387 9.52295 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.27307 9.40686 11.8246 5.10938 5.47319 12.3994 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 6.92837 9.40686 3.85648 5.10938 9.8809 12.3994 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 9.96446 7.69672 12.6706 5.27016 8.4545 12.2787 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 6.70686 7.69672 8.52106 5.27016 7.01176 12.2787 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 8.60857 5.52502 3.99091 6.89612 8.181 4.78944 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 5.06555 6.21509 4.98499 8.75149 7.04864 11.6385 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 6.44195 5.7306 4.66975 5.32921 9.93555 10.2139 numMergedOcc 0
10 mol 154 unq 1 iso 0 dist 7.34207 5.7306 9.20471 9.95968 6.23399 12.1431 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 6.53913 7.71402 6.38496 4.88159 5.59806 6.00793 numMergedOcc 0
12 mol 167 unq 1 iso 0 dist 6.53913 4.74768 8.09332 4.88159 5.59806 9.12568 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 6.0639 9.02321 5.04574 4.40927 7.80299 9.21553 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 5.82039 9.1579 6.13816 8.60571 9.78438 6.38964 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 7.49412 6.53528 6.18809 10.8749 7.89744 13.4385 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 7.49412 6.53528 6.18809 7.38199 8.6417 11.1364 numMergedOcc 0
