0 mol 11 unq 0 iso 0 dist 9.52695 9.07476 6.76736 9.89387 11.9176 5.47299 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.78754 9.04534 6.51674 9.85415 11.6776 5.40468 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.67162 6.35779 4.32751 5.02909 12.3621 8.96898 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 8.79114 6.35779 4.83294 5.02909 11.1439 8.96898 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 6.85867 9.40699 5.46401 12.0479 12.2721 8.73208 numMergedOcc 0
5 mol 88 unq 1 iso 0 dist 6.85867 9.40699 5.46401 9.40927 8.20319 5.60174 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 5.59552 6.04223 6.882 4.40127 8.70435 9.60046 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 5.62309 7.29864 3.79182 14.7098 12.3755 9.60046 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 7.11438 7.29864 9.74373 14.7098 16.2355 9.60046 numMergedOcc 0
9 mol 93 unq 0 iso 0 dist 7.4518 5.10693 4.34681 4.1947 8.69945 8.24402 numMergedOcc 0
10 mol 93 unq 1 iso 0 dist 7.4518 6.58814 5.73248 9.45097 11.35 9.44156 numMergedOcc 0
11 mol 93 unq 2 iso 0 dist 7.4518 6.13459 13.5809 4.1947 8.69945 7.14241 numMergedOcc 0
12 mol 93 unq 3 iso 0 dist 9.1687 5.10693 9.11796 4.1947 13.0511 8.24402 numMergedOcc 0
13 mol 93 unq 4 iso 0 dist 9.1687 6.58814 7.24672 9.45097 8.77074 9.44156 numMergedOcc 0
14 mol 93 unq 5 iso 0 dist 9.1687 6.13459 10.6039 4.1947 13.0511 7.14241 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 5.60184 6.12278 4.03185 3.82471 8.60004 8.76245 numMergedOcc 0
16 mol 154 unq 1 iso 0 dist 8.86862 6.12278 11.2909 3.82471 10.6705 8.76245 numMergedOcc 0
17 mol 154 unq 2 iso 0 dist 7.08477 6.12278 9.94519 3.82471 10.0692 8.76245 numMergedOcc 0
18 mol 168 unq 0 iso 0 dist 8.90876 8.97414 8.8681 4.65845 5.24076 5.64732 numMergedOcc 0
19 mol 168 unq 1 iso 0 dist 8.90876 8.00063 5.71136 4.65845 5.24076 5.80055 numMergedOcc 0
20 mol 169 unq 0 iso 0 dist 8.17917 7.78577 7.83748 11.8115 9.47253 6.27378 numMergedOcc 0
21 mol 171 unq 0 iso 0 dist 6.80086 7.06555 3.72812 4.29743 10.6041 9.73554 numMergedOcc 0
22 mol 171 unq 1 iso 0 dist 6.80086 7.06555 3.72812 4.78402 9.00621 8.65769 numMergedOcc 0
23 mol 180 unq 0 iso 0 dist 9.54753 6.91244 9.19793 8.4055 16.9474 9.48707 numMergedOcc 0
24 mol 180 unq 1 iso 0 dist 8.79411 6.91244 3.77126 8.4055 12.5102 9.48707 numMergedOcc 0
25 mol 210 unq 0 iso 0 dist 9.26092 9.49242 3.71145 7.8713 9.32761 6.58557 numMergedOcc 0
26 mol 244 unq 0 iso 0 dist 5.79898 5.16859 10.1665 8.49995 10.2667 9.07512 numMergedOcc 0
27 mol 260 unq 0 iso 0 dist 5.68717 9.46576 7.28821 9.87568 10.1774 4.76164 numMergedOcc 0
28 mol 268 unq 0 iso 0 dist 8.6745 6.18877 3.75857 10.5447 6.68794 9.06348 numMergedOcc 0
29 mol 270 unq 0 iso 0 dist 8.50042 8.76202 6.72549 7.74086 13.6916 9.47295 numMergedOcc 0
