0 mol 20 unq 0 iso 0 dist 4.15066 6.75769 7.6974 7.50142 7.69558 9.84488 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 6.53312 6.95803 8.76224 14.812 14.5838 8.47637 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 5.9948 4.3475 8.76224 11.9771 14.5838 8.47637 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 4.85282 4.85685 6.35779 6.93243 3.54604 5.83263 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 9.79535 7.19267 9.40699 14.6343 9.38171 9.06249 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 9.35529 5.79975 9.16089 11.3088 9.38441 9.43682 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 8.94007 5.76262 8.76449 6.16995 12.2295 9.28718 numMergedOcc 0
7 mol 176 unq 0 iso 0 dist 6.55106 7.69131 8.51811 8.27087 4.57491 5.60333 numMergedOcc 0
8 mol 176 unq 1 iso 0 dist 6.55106 5.25264 7.26558 8.27087 4.57491 5.58647 numMergedOcc 0
9 mol 176 unq 2 iso 0 dist 8.08891 4.53563 8.51811 7.71329 4.57491 5.60333 numMergedOcc 0
10 mol 176 unq 3 iso 0 dist 8.08891 3.97245 7.26558 7.71329 4.57491 5.58647 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.37765 3.98361 9.14525 13.0035 13.3009 9.64977 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 5.07395 9.59663 9.49242 18.5893 17.502 9.41473 numMergedOcc 0
13 mol 210 unq 1 iso 0 dist 9.35577 15.1177 9.49242 23.5472 17.502 9.41473 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 6.50591 6.47265 7.45831 6.24316 3.76066 8.15802 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 6.17749 4.73685 4.90656 6.70789 6.37759 8.47836 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 9.29276 4.01942 9.58816 7.08055 3.73947 8.69082 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 4.76689 5.30931 7.88108 12.4684 10.7811 9.68243 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 8.79012 8.90225 7.88108 14.0641 10.7811 9.68243 numMergedOcc 0
19 mol 270 unq 0 iso 0 dist 4.60602 9.89802 7.97614 10.037 6.1174 6.85081 numMergedOcc 0
20 mol 270 unq 1 iso 0 dist 6.62637 8.63373 7.97614 7.7975 6.1174 6.85081 numMergedOcc 0
