0 mol 24 unq 0 iso 0 dist 4.61828 8.14598 4.47891 9.20254 6.60423 7.95042 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 4.61828 8.14598 4.47891 8.8926 7.83786 11.6516 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 5.2746 7.82815 4.92283 5.62472 8.00177 10.0077 numMergedOcc 0
3 mol 51 unq 0 iso 0 dist 9.42071 7.73836 5.9318 10.1569 7.76282 12.2673 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 8.83047 9.73556 11.4508 14.3035 7.09169 18.3087 numMergedOcc 0
5 mol 53 unq 1 iso 0 dist 6.95013 8.79235 14.7368 5.02495 7.09169 13.3389 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 8.84146 8.93181 7.73675 13.7656 7.77116 14.8987 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 4.85559 9.67398 6.76477 7.09664 8.33077 6.93139 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 9.19078 9.40483 4.71678 7.17016 9.77552 6.59889 numMergedOcc 0
9 mol 152 unq 1 iso 0 dist 9.19078 9.40483 4.71678 11.3742 8.28642 6.70693 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 4.97005 9.76574 9.40383 11.3961 9.56197 16.711 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 4.97005 9.76574 9.40383 10.0248 7.24795 8.73533 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 4.97005 9.76574 9.40383 9.14781 8.64409 17.684 numMergedOcc 0
13 mol 186 unq 3 iso 0 dist 4.97005 9.76574 9.40383 6.69897 7.60202 13.8845 numMergedOcc 0
14 mol 186 unq 4 iso 0 dist 5.67811 9.77333 7.26749 9.13357 7.28841 10.5974 numMergedOcc 0
15 mol 210 unq 0 iso 0 dist 9.05206 8.25288 6.75621 8.99603 7.63018 8.63693 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 8.768 8.94981 6.35462 6.89798 6.6561 6.50998 numMergedOcc 0
17 mol 225 unq 1 iso 0 dist 8.768 5.90986 5.94765 6.89798 6.6561 9.09424 numMergedOcc 0
18 mol 225 unq 2 iso 0 dist 8.768 7.50697 11.2847 6.89798 6.6561 8.14831 numMergedOcc 0
19 mol 251 unq 0 iso 0 dist 5.0953 8.07576 9.29305 5.6933 8.01198 12.7504 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.98606 8.62843 10.4051 6.01492 7.71657 11.4049 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 8.84798 5.61134 8.8725 13.8061 8.29305 15.6964 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 8.84798 5.61134 8.8725 7.7504 6.43341 10.0975 numMergedOcc 0
