0 mol 15 unq 0 iso 0 dist 5.70754 7.42909 5.68079 5.19544 5.69755 6.88546 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 9.54314 4.44905 6.89855 6.88374 7.1742 5.55574 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 7.06029 6.05149 6.65972 13.5556 10.2709 7.99438 numMergedOcc 0
3 mol 79 unq 1 iso 0 dist 7.06029 6.05149 6.65972 12.4799 9.87964 6.64915 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 9.40699 5.53481 5.6516 6.85867 5.46401 7.01545 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 5.48163 6.18402 4.91714 6.37888 3.98877 5.74593 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 5.48163 6.18402 4.91714 11.9724 8.90513 8.02376 numMergedOcc 0
7 mol 92 unq 2 iso 0 dist 7.7399 11.011 4.91714 7.11438 3.98877 5.74593 numMergedOcc 0
8 mol 92 unq 3 iso 0 dist 7.7399 11.011 4.91714 13.2241 8.90513 8.02376 numMergedOcc 0
9 mol 92 unq 4 iso 0 dist 8.23055 6.56343 6.34669 9.7872 3.77771 7.31426 numMergedOcc 0
10 mol 92 unq 5 iso 0 dist 8.30746 9.1793 6.34669 10.2815 3.77771 7.31426 numMergedOcc 0
11 mol 92 unq 6 iso 0 dist 7.33353 9.44377 8.01266 10.5329 4.15826 6.6186 numMergedOcc 0
12 mol 93 unq 0 iso 0 dist 5.10693 8.97237 8.55758 9.82649 5.64998 7.13064 numMergedOcc 0
13 mol 93 unq 1 iso 0 dist 5.10693 8.97237 8.55758 7.4518 4.34681 7.8962 numMergedOcc 0
14 mol 93 unq 2 iso 0 dist 6.58814 8.97237 7.44027 9.82649 4.76749 7.13064 numMergedOcc 0
15 mol 93 unq 3 iso 0 dist 6.58814 8.97237 7.44027 7.4518 5.73248 7.8962 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 9.68556 6.99582 9.45257 9.25249 3.61204 7.48563 numMergedOcc 0
17 mol 98 unq 1 iso 0 dist 8.73928 4.34199 9.45257 8.41411 3.61204 7.48563 numMergedOcc 0
18 mol 120 unq 0 iso 0 dist 9.18784 5.65554 7.06763 9.41356 4.26413 5.12002 numMergedOcc 0
19 mol 120 unq 1 iso 0 dist 9.18784 5.65554 7.06763 10.6645 3.64386 8.46914 numMergedOcc 0
20 mol 192 unq 0 iso 0 dist 5.05414 8.19854 5.5223 15.3295 11.5634 7.37823 numMergedOcc 0
21 mol 192 unq 1 iso 0 dist 7.16964 8.19854 8.00501 15.3295 12.3784 7.37823 numMergedOcc 0
22 mol 204 unq 0 iso 0 dist 8.49554 5.55359 9.92651 11.7905 9.07662 9.46973 numMergedOcc 0
23 mol 204 unq 1 iso 0 dist 8.29256 4.72843 9.92651 8.62191 9.07662 9.46973 numMergedOcc 0
24 mol 230 unq 0 iso 0 dist 6.99256 6.28086 8.01593 10.4536 6.2222 8.85051 numMergedOcc 0
25 mol 253 unq 0 iso 0 dist 8.71119 9.53082 6.3093 9.34735 6.06804 8.64294 numMergedOcc 0
26 mol 254 unq 0 iso 0 dist 9.09568 5.54706 5.83039 11.6422 4.4384 7.00841 numMergedOcc 0
27 mol 254 unq 1 iso 0 dist 9.99168 5.54706 6.74364 11.6422 6.09569 7.00841 numMergedOcc 0
28 mol 254 unq 2 iso 0 dist 7.84221 8.87361 5.83039 10.6392 4.4384 7.00841 numMergedOcc 0
29 mol 254 unq 3 iso 0 dist 9.67383 8.87361 6.74364 10.6392 6.09569 7.00841 numMergedOcc 0
30 mol 254 unq 4 iso 0 dist 7.89302 10.4935 9.84028 14.055 11.9238 7.28781 numMergedOcc 0
31 mol 272 unq 0 iso 0 dist 9.99134 8.01135 9.30035 12.332 6.85669 8.86801 numMergedOcc 0
32 mol 272 unq 1 iso 0 dist 9.99134 7.26353 9.51185 12.332 6.85669 7.15093 numMergedOcc 0
33 mol 280 unq 0 iso 0 dist 9.22665 9.13465 7.00616 14.0112 8.71368 9.38952 numMergedOcc 0
34 mol 280 unq 1 iso 0 dist 9.84708 7.59724 7.00616 16.2914 8.71368 9.38952 numMergedOcc 0
35 mol 285 unq 0 iso 0 dist 5.28731 6.37482 7.08681 8.65334 8.21781 6.46935 numMergedOcc 0
