0 mol 103 unq 0 iso 0 dist 8.70106 11.4822 7.81042 14.0531 6.56481 5.73608 13.6456 5.86578 11.9113 8.23356 numMergedOcc 0
1 mol 114 unq 0 iso 0 dist 9.15982 14.0132 9.6874 11.2753 6.54778 4.84565 18.5509 11.5575 11.3418 8.79677 numMergedOcc 0
2 mol 129 unq 0 iso 0 dist 7.48833 13.4277 8.34427 14.3839 9.52061 7.12885 17.5691 12.2874 11.6486 5.16531 numMergedOcc 0
3 mol 132 unq 0 iso 0 dist 7.14447 12.8539 8.15549 9.07803 9.39389 10.8474 10.7969 7.53392 12.8674 8.72039 numMergedOcc 0
4 mol 158 unq 0 iso 0 dist 8.34722 6.26228 7.07348 10.6035 9.96635 10.9312 15.621 11.2678 11.946 8.80952 numMergedOcc 0
5 mol 167 unq 0 iso 0 dist 6.6514 10.8805 9.82329 8.3419 7.20545 9.97915 10.5102 5.44954 12.7444 6.28957 numMergedOcc 0
6 mol 167 unq 1 iso 0 dist 6.6514 10.8805 9.82329 8.3419 7.20545 9.97915 13.6417 9.15105 14.7796 7.34285 numMergedOcc 0
7 mol 189 unq 0 iso 0 dist 9.71306 6.58275 5.11059 8.18227 9.47321 8.03657 13.7517 10.2802 13.0356 9.01418 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 9.67207 8.0557 7.30965 4.64973 6.2016 5.21255 12.4049 13.2525 7.252 9.78743 numMergedOcc 0
9 mol 226 unq 0 iso 0 dist 7.6174 8.00807 7.20862 5.92917 8.74399 12.3908 6.54042 9.96567 12.1792 9.03261 numMergedOcc 0
10 mol 245 unq 0 iso 0 dist 7.1207 5.75694 7.26913 7.10254 7.95061 11.8346 10.5858 5.43086 11.5225 9.59668 numMergedOcc 0
11 mol 245 unq 1 iso 0 dist 7.1207 6.87827 6.41862 7.10254 7.95061 3.53109 10.5858 5.43086 6.58637 9.59668 numMergedOcc 0
12 mol 245 unq 2 iso 0 dist 7.1207 9.93908 8.69377 7.10254 7.95061 9.71014 10.5858 5.43086 5.48167 9.59668 numMergedOcc 0
