0 mol 11 unq 0 iso 0 dist 5.7435 11.1513 9.53002 11.4417 10.9183 8.73067 4.24301 6.35398 7.5901 7.98326 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.7435 11.1513 9.53002 11.4417 10.9183 8.73067 10.4568 13.5138 12.5553 7.46578 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 5.97635 8.98505 5.02241 4.38047 4.29856 6.30987 10.5895 10.4031 6.85072 9.17082 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.2377 12.6436 5.64598 16.651 8.44406 7.10439 22.2404 14.571 9.79695 8.87464 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.18305 4.31731 4.65521 9.54477 6.56633 7.10439 8.04207 10.2755 9.79695 8.87464 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.58841 13.8628 8.19682 14.8689 6.45686 7.03226 15.7152 9.38371 9.24521 8.95905 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 7.91337 6.02826 7.39889 8.4733 5.92984 7.26955 5.73999 9.84094 4.48922 7.20249 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 9.92932 6.27009 8.79571 12.1527 4.57832 8.73604 18.3345 10.5252 14.1488 6.40575 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 9.60411 6.27009 5.42582 12.1527 5.29786 8.73604 18.3345 10.7586 14.1488 6.40575 numMergedOcc 0
9 mol 134 unq 2 iso 0 dist 9.55556 10.2625 8.79571 11.9876 4.57832 8.73604 17.6193 10.5252 14.1488 6.40575 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 9.84952 11.14 7.98142 13.401 5.63555 5.97685 18.3673 11.9764 11.2039 7.22883 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 9.84952 10.9006 7.37327 13.401 5.63555 8.9289 18.3673 11.9764 15.9559 7.22883 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 7.70279 6.17401 7.07392 9.41148 6.2188 7.10413 6.36084 8.50102 10.9886 9.78181 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 9.32451 4.81145 6.05141 11.4318 5.50308 6.73446 16.2294 8.94014 11.5793 5.92374 numMergedOcc 0
14 mol 256 unq 0 iso 0 dist 7.67598 9.40096 5.24676 12.4604 7.7384 9.18903 15.1447 11.9549 10.4051 6.37963 numMergedOcc 0
15 mol 256 unq 1 iso 0 dist 7.67598 9.40096 5.24676 12.4604 7.7384 9.18903 15.2988 13.0251 13.9633 6.00636 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 6.55855 5.95459 9.19234 6.83113 5.64601 9.20749 5.15747 6.39866 4.60275 9.16942 numMergedOcc 0
