0 mol 4 unq 0 iso 0 dist 9.32861 7.00324 9.45622 7.29403 7.99815 7.91149 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 9.32861 9.62716 13.3656 7.29403 7.99815 5.39676 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 7.95375 9.76481 4.4678 8.85204 11.0428 14.2436 numMergedOcc 0
3 mol 20 unq 0 iso 0 dist 6.12382 5.21143 3.61632 8.36009 6.22202 9.0513 numMergedOcc 0
4 mol 20 unq 1 iso 0 dist 6.12382 5.75338 4.32143 8.36009 6.22202 4.49878 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 7.94809 6.27321 13.6446 4.9983 10.6352 3.99506 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 9.41961 5.40928 5.69897 7.34645 11.9297 6.36433 numMergedOcc 0
7 mol 70 unq 1 iso 0 dist 9.29166 5.76805 5.69897 9.87737 15.5765 10.0384 numMergedOcc 0
8 mol 70 unq 2 iso 0 dist 9.29166 5.76805 5.69897 6.7303 11.9297 6.36433 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 6.35752 8.64736 3.69039 5.98764 10.9695 14.0777 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 8.88238 8.64736 15.0328 5.98764 11.0673 14.0777 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 7.69672 6.15011 12.4367 4.96173 10.7169 3.79182 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 9.39787 8.51206 4.31811 8.85675 8.20377 4.8632 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 9.40368 7.35647 3.76328 6.90456 5.11518 3.90693 numMergedOcc 0
14 mol 130 unq 1 iso 0 dist 7.14034 4.88366 3.76328 8.14525 5.11518 3.90693 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 6.58855 8.59976 13.1373 7.07933 8.64393 5.68902 numMergedOcc 0
16 mol 169 unq 1 iso 0 dist 6.58855 9.71763 12.3204 7.07933 8.64393 3.83687 numMergedOcc 0
17 mol 180 unq 0 iso 0 dist 8.90665 8.92145 5.83084 5.70326 4.56845 3.77126 numMergedOcc 0
18 mol 180 unq 1 iso 0 dist 8.90665 8.67796 4.31451 5.70326 4.56845 5.46832 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.13982 6.19189 7.65999 9.6283 5.64335 5.70845 numMergedOcc 0
20 mol 195 unq 0 iso 0 dist 8.77346 5.0778 6.12638 9.33055 13.0944 9.70528 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 9.80084 9.45718 10.5102 8.35976 3.3957 9.81397 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 9.80084 8.56826 8.85081 8.35976 3.3957 9.54595 numMergedOcc 0
23 mol 197 unq 2 iso 0 dist 7.34627 9.45718 6.81738 8.35976 11.4868 9.81397 numMergedOcc 0
24 mol 197 unq 3 iso 0 dist 7.34627 8.56826 3.69112 8.35976 11.4868 9.54595 numMergedOcc 0
25 mol 197 unq 4 iso 0 dist 8.05081 9.45718 6.65205 8.35976 13.3465 9.81397 numMergedOcc 0
26 mol 197 unq 5 iso 0 dist 8.05081 8.56826 6.51187 8.35976 13.3465 9.54595 numMergedOcc 0
27 mol 197 unq 6 iso 0 dist 5.38508 9.45718 6.84735 8.35976 11.2924 9.81397 numMergedOcc 0
28 mol 197 unq 7 iso 0 dist 5.38508 8.56826 7.92095 8.35976 11.2924 9.54595 numMergedOcc 0
29 mol 197 unq 8 iso 0 dist 6.51529 9.45718 10.9225 8.35976 14.0042 9.81397 numMergedOcc 0
30 mol 197 unq 9 iso 0 dist 6.51529 8.56826 11.6499 8.35976 14.0042 9.54595 numMergedOcc 0
31 mol 206 unq 0 iso 0 dist 6.09565 9.24801 6.3231 8.42431 10.3983 8.90838 numMergedOcc 0
32 mol 235 unq 0 iso 0 dist 7.79729 5.98104 3.81221 7.8548 5.70734 3.66752 numMergedOcc 0
33 mol 266 unq 0 iso 0 dist 9.85095 8.31182 12.6333 7.96613 16.1366 14.8481 numMergedOcc 0
34 mol 266 unq 1 iso 0 dist 8.25191 8.31182 15.5391 7.96613 9.94662 14.8481 numMergedOcc 0
35 mol 266 unq 2 iso 0 dist 7.35056 8.31182 13.1627 7.96613 10.4118 14.8481 numMergedOcc 0
36 mol 270 unq 0 iso 0 dist 8.19788 6.97639 11.4433 8.93961 4.41063 9.06597 numMergedOcc 0
37 mol 270 unq 1 iso 0 dist 8.19788 6.97639 11.4433 7.96508 15.6327 6.72549 numMergedOcc 0
38 mol 277 unq 0 iso 0 dist 7.89017 7.64361 6.17749 7.05489 6.54549 10.646 numMergedOcc 0
