0 mol 11 unq 0 iso 0 dist 9.52695 9.07476 6.76736 10.5382 12.8782 9.74528 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 5.19544 5.70754 5.69755 7.42909 6.88546 5.68079 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 6.88374 9.54314 7.1742 4.44905 5.55574 6.89855 numMergedOcc 0
3 mol 63 unq 1 iso 0 dist 6.88374 9.54314 7.1742 6.25029 10.2621 7.85738 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.91502 5.75135 10.4849 12.8471 14.54 7.17133 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 6.85867 8.56269 9.33803 3.8048 10.3829 8.86094 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 6.85867 9.40699 5.46401 5.53481 7.01545 5.6516 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 5.62309 7.7399 8.93569 11.011 11.8611 4.91714 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 6.37888 5.48163 3.98877 6.18402 5.74593 4.91714 numMergedOcc 0
9 mol 92 unq 2 iso 0 dist 7.11438 7.7399 3.98877 11.011 5.74593 4.91714 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 7.4518 5.10693 4.34681 8.97237 7.8962 8.55758 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 7.4518 6.58814 5.73248 8.97237 7.8962 7.44027 numMergedOcc 0
12 mol 93 unq 2 iso 0 dist 9.1687 5.10693 9.11796 8.97237 10.092 8.55758 numMergedOcc 0
13 mol 93 unq 3 iso 0 dist 9.1687 6.58814 7.24672 8.97237 10.092 7.44027 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 9.25249 9.68556 3.61204 6.99582 7.48563 9.45257 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 8.41411 8.73928 3.61204 4.34199 7.48563 9.45257 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 6.72323 8.52036 12.7291 6.49614 13.074 6.67937 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 8.62191 8.29256 9.07662 4.72843 9.46973 9.92651 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 7.23557 8.93485 9.43113 11.2438 15.8908 8.83628 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 8.86587 5.66636 9.43113 7.47443 15.8908 8.83628 numMergedOcc 0
20 mol 210 unq 0 iso 0 dist 9.26092 9.49242 3.71145 13.3519 11.4209 7.95917 numMergedOcc 0
21 mol 253 unq 0 iso 0 dist 9.34735 8.71119 6.06804 9.53082 8.64294 6.3093 numMergedOcc 0
22 mol 257 unq 0 iso 0 dist 8.4302 9.82105 3.96862 15.5338 12.0904 8.23073 numMergedOcc 0
23 mol 260 unq 0 iso 0 dist 5.68717 9.46576 7.28821 13.9264 10.4828 6.90472 numMergedOcc 0
