0 mol 18 unq 0 iso 0 dist 5.94326 9.00899 4.25448 5.03451 6.16971 10.3665 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 5.94326 7.826 9.07359 5.03451 6.16971 3.17053 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 7.06922 9.72136 9.59822 9.942 11.8315 3.7765 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 7.06922 9.72136 9.59822 5.92771 9.41508 13.4768 numMergedOcc 0
4 mol 46 unq 2 iso 0 dist 7.06922 4.61355 10.3583 9.942 11.8315 9.44812 numMergedOcc 0
5 mol 46 unq 3 iso 0 dist 7.06922 4.61355 10.3583 5.92771 9.41508 6.08836 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 9.11976 5.92285 7.80474 6.42645 10.0397 5.98227 numMergedOcc 0
7 mol 62 unq 1 iso 0 dist 9.11976 8.38687 6.57724 6.42645 10.0397 5.87787 numMergedOcc 0
8 mol 83 unq 0 iso 0 dist 6.21251 6.61587 9.23738 6.72584 11.2465 3.31218 numMergedOcc 0
9 mol 83 unq 1 iso 0 dist 6.21251 6.61587 9.23738 7.25594 10.2227 5.74818 numMergedOcc 0
10 mol 83 unq 2 iso 0 dist 6.21251 8.24464 6.27705 6.72584 11.2465 9.11262 numMergedOcc 0
11 mol 83 unq 3 iso 0 dist 6.21251 8.24464 6.27705 7.25594 10.2227 9.84043 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 6.13194 9.43076 13.3309 7.85115 5.59536 14.3087 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 4.84604 7.09831 5.30466 7.84085 3.75786 5.87276 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 7.94258 8.1368 5.19932 8.72521 11.167 8.92479 numMergedOcc 0
15 mol 143 unq 1 iso 0 dist 7.94258 8.1368 5.19932 8.19373 10.9987 9.04685 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 6.81055 9.8506 8.51158 7.91749 13.2009 13.5156 numMergedOcc 0
17 mol 150 unq 0 iso 0 dist 6.77966 9.91991 8.45996 7.96309 13.2057 13.6094 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 5.16184 8.45614 9.16709 8.43599 7.27394 12.3855 numMergedOcc 0
19 mol 237 unq 0 iso 0 dist 8.81333 6.16312 11.6072 5.27463 6.50729 5.88058 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 9.86647 6.52085 13.0872 4.69611 9.61671 6.53775 numMergedOcc 0
21 mol 284 unq 1 iso 0 dist 9.86647 9.84174 12.4311 4.69611 9.61671 13.4014 numMergedOcc 0
