0 mol 17 unq 0 iso 0 dist 6.76604 8.58468 8.23357 9.83791 11.5852 13.7814 numMergedOcc 0
1 mol 17 unq 0 iso 1 dist 6.76604 9.83791 11.5852 8.58468 8.23357 13.7814 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 6.76604 8.58468 8.23357 7.95007 12.3685 11.1609 numMergedOcc 0
3 mol 17 unq 1 iso 1 dist 6.76604 7.95007 12.3685 8.58468 8.23357 11.1609 numMergedOcc 0
4 mol 17 unq 1 iso 0 dist 6.76604 9.83791 11.5852 7.95007 12.3685 6.24514 numMergedOcc 0
5 mol 17 unq 1 iso 1 dist 6.76604 7.95007 12.3685 9.83791 11.5852 6.24514 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 5.76314 6.25196 4.11549 8.88159 8.12687 5.58256 numMergedOcc 0
7 mol 54 unq 0 iso 1 dist 5.76314 8.88159 8.12687 6.25196 4.11549 5.58256 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 7.52742 9.37034 4.77114 6.60091 4.4924 9.06957 numMergedOcc 0
9 mol 85 unq 0 iso 1 dist 7.52742 6.60091 4.4924 9.37034 4.77114 9.06957 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 8.56629 6.24768 8.52343 9.31875 12.1942 4.48374 numMergedOcc 0
11 mol 116 unq 0 iso 1 dist 8.56629 9.31875 12.1942 6.24768 8.52343 4.48374 numMergedOcc 0
12 mol 116 unq 1 iso 0 dist 7.56091 6.24768 5.93763 9.31875 10.3148 4.48374 numMergedOcc 0
13 mol 116 unq 1 iso 1 dist 7.56091 9.31875 10.3148 6.24768 5.93763 4.48374 numMergedOcc 0
14 mol 125 unq 0 iso 0 dist 7.0188 9.5205 13.2837 7.1608 8.93863 4.6635 numMergedOcc 0
15 mol 125 unq 0 iso 1 dist 7.0188 7.1608 8.93863 9.5205 13.2837 4.6635 numMergedOcc 0
16 mol 140 unq 0 iso 0 dist 8.15605 9.16949 4.46614 8.65294 4.74205 5.17212 numMergedOcc 0
17 mol 140 unq 0 iso 1 dist 8.15605 8.65294 4.74205 9.16949 4.46614 5.17212 numMergedOcc 0
18 mol 247 unq 0 iso 0 dist 6.52457 9.1947 5.35312 6.97395 5.05326 10.3906 numMergedOcc 0
19 mol 247 unq 0 iso 1 dist 6.52457 6.97395 5.05326 9.1947 5.35312 10.3906 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 9.5174 9.87771 4.15537 9.10723 9.72043 9.67016 numMergedOcc 0
21 mol 279 unq 0 iso 1 dist 9.5174 9.10723 9.72043 9.87771 4.15537 9.67016 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 5.06731 4.75392 6.45653 8.61667 9.67944 5.04495 numMergedOcc 0
23 mol 287 unq 0 iso 1 dist 5.06731 8.61667 9.67944 4.75392 6.45653 5.04495 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 5.06731 4.75392 6.45653 8.61667 9.67944 5.04495 numMergedOcc 0
25 mol 288 unq 0 iso 1 dist 5.06731 8.61667 9.67944 4.75392 6.45653 5.04495 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 5.06731 4.75392 6.45653 8.61667 9.67944 5.04495 numMergedOcc 0
27 mol 289 unq 0 iso 1 dist 5.06731 8.61667 9.67944 4.75392 6.45653 5.04495 numMergedOcc 0
