0 mol 30 unq 0 iso 0 dist 5.71014 7.92586 8.85178 5.66702 7.24295 13.3488 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 6.27321 4.9983 3.99506 6.38389 6.34966 4.90093 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 8.51206 8.85675 4.8632 10.5189 9.10677 13.2944 numMergedOcc 0
3 mol 112 unq 0 iso 0 dist 8.65004 6.79584 7.45152 11.2572 9.75656 15.2557 numMergedOcc 0
4 mol 112 unq 1 iso 0 dist 9.86487 6.79584 16.6124 15.6815 9.69961 21.7853 numMergedOcc 0
5 mol 156 unq 0 iso 0 dist 6.01599 8.08259 12.8363 10.28 7.70894 16.4422 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 8.76308 8.86574 5.39534 4.62432 9.53805 7.005 numMergedOcc 0
7 mol 205 unq 0 iso 0 dist 6.79634 4.72209 4.76454 5.03046 6.05667 5.32465 numMergedOcc 0
8 mol 214 unq 0 iso 0 dist 6.90717 6.26596 4.05067 5.26468 7.43301 9.38177 numMergedOcc 0
9 mol 230 unq 0 iso 0 dist 5.75445 8.32382 8.76971 5.58962 7.48445 13.6432 numMergedOcc 0
10 mol 235 unq 0 iso 0 dist 4.46919 8.28824 6.82702 5.71985 6.20377 12.6016 numMergedOcc 0
11 mol 256 unq 0 iso 0 dist 5.58036 7.53873 4.26681 8.44971 7.40057 10.1266 numMergedOcc 0
12 mol 265 unq 0 iso 0 dist 7.87337 9.40917 10.6179 9.6551 7.49913 11.8276 numMergedOcc 0
13 mol 265 unq 1 iso 0 dist 7.87337 5.44039 6.31696 9.6551 7.49913 6.80043 numMergedOcc 0
