0 mol 24 unq 0 iso 0 dist 9.54519 12.1061 8.4051 13.8227 13.6174 5.80953 12.8473 11.2485 6.99746 8.24948 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.54519 6.53276 8.23446 6.36381 5.50396 4.44526 4.36056 11.9933 9.22115 7.96195 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.54519 6.81998 8.75662 6.36381 5.50396 9.586 4.36056 11.9933 9.15493 7.96195 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.11056 11.095 8.60554 10.4056 5.11636 5.80953 5.36722 6.72502 6.99746 8.24948 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 6.11056 6.66757 9.44691 15.2305 14.4081 9.586 12.5331 10.9839 9.15493 7.96195 numMergedOcc 0
5 mol 41 unq 0 iso 0 dist 5.41493 4.08339 8.51663 9.74532 13.4019 6.21128 7.51317 9.57606 4.85777 7.56029 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 5.9747 7.43001 6.65501 14.2657 10.4782 8.46823 18.6754 15.6191 11.4207 6.83746 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 5.9747 7.43001 6.65501 14.2657 10.4782 8.46823 15.0551 12.285 8.26478 9.14707 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 5.9747 7.43001 6.65501 8.3505 3.9764 4.62494 8.89866 7.26086 11.2092 8.75597 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 5.9747 7.43001 6.65501 8.3505 3.9764 4.62494 15.0551 12.285 8.26478 9.18457 numMergedOcc 0
10 mol 98 unq 4 iso 0 dist 4.50572 9.5305 6.65501 14.7607 10.4782 8.46823 19.8338 15.6191 11.4207 6.83746 numMergedOcc 0
11 mol 98 unq 5 iso 0 dist 4.50572 9.5305 6.65501 14.7607 10.4782 8.46823 16.0082 12.285 8.26478 9.14707 numMergedOcc 0
12 mol 98 unq 6 iso 0 dist 4.50572 9.5305 6.65501 8.32269 3.9764 4.62494 7.87523 7.26086 11.2092 8.75597 numMergedOcc 0
13 mol 98 unq 7 iso 0 dist 4.50572 9.5305 6.65501 8.32269 3.9764 4.62494 16.0082 12.285 8.26478 9.18457 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 8.30654 11.6678 7.78652 12.027 4.78563 5.06564 5.82537 7.25673 6.60479 8.612 numMergedOcc 0
15 mol 143 unq 1 iso 0 dist 8.30654 11.347 8.91301 12.027 4.78563 7.5373 5.82537 7.25673 7.54337 8.612 numMergedOcc 0
16 mol 159 unq 0 iso 0 dist 7.97007 6.69743 8.4858 10.0117 4.48323 9.35202 6.23157 7.25742 7.97232 6.07821 numMergedOcc 0
17 mol 171 unq 0 iso 0 dist 6.07091 4.98945 9.61462 6.51523 7.5383 7.47964 14.0377 14.5662 11.6944 8.999 numMergedOcc 0
18 mol 195 unq 0 iso 0 dist 7.63036 7.14066 7.36683 10.6446 5.41635 6.22742 6.90444 6.60567 6.0634 6.34234 numMergedOcc 0
19 mol 212 unq 0 iso 0 dist 5.87223 6.48939 8.69988 5.03184 3.9436 9.10288 6.8255 6.29767 12.8059 5.50658 numMergedOcc 0
20 mol 212 unq 1 iso 0 dist 5.87223 6.48939 8.69988 5.03184 3.9436 9.10288 9.6542 11.1501 7.75271 9.10095 numMergedOcc 0
21 mol 212 unq 2 iso 0 dist 5.87223 6.48939 8.69988 5.03184 3.9436 9.10288 8.90296 8.74585 4.21442 9.22129 numMergedOcc 0
22 mol 212 unq 3 iso 0 dist 5.87223 5.81626 8.55903 5.03184 3.9436 6.19798 6.8255 6.29767 10.7914 5.50658 numMergedOcc 0
23 mol 212 unq 4 iso 0 dist 5.87223 5.81626 8.55903 5.03184 3.9436 6.19798 9.6542 11.1501 4.01146 9.10095 numMergedOcc 0
24 mol 212 unq 5 iso 0 dist 5.87223 5.81626 8.55903 5.03184 3.9436 6.19798 8.90296 8.74585 6.69225 9.22129 numMergedOcc 0
25 mol 212 unq 6 iso 0 dist 8.062 10.4595 8.69988 11.3822 3.9436 9.10288 11.009 6.29767 12.8059 5.50658 numMergedOcc 0
26 mol 212 unq 7 iso 0 dist 8.062 10.4595 8.69988 11.3822 3.9436 9.10288 16.7871 11.1501 7.75271 9.10095 numMergedOcc 0
27 mol 212 unq 8 iso 0 dist 8.062 10.4595 8.69988 11.3822 3.9436 9.10288 12.2246 8.74585 4.21442 9.22129 numMergedOcc 0
28 mol 212 unq 9 iso 0 dist 8.062 14.0193 8.55903 11.3822 3.9436 6.19798 11.009 6.29767 10.7914 5.50658 numMergedOcc 0
29 mol 212 unq 10 iso 0 dist 8.062 14.0193 8.55903 11.3822 3.9436 6.19798 16.7871 11.1501 4.01146 9.10095 numMergedOcc 0
30 mol 212 unq 11 iso 0 dist 8.062 14.0193 8.55903 11.3822 3.9436 6.19798 12.2246 8.74585 6.69225 9.22129 numMergedOcc 0
31 mol 212 unq 12 iso 0 dist 8.70011 8.87823 8.69988 9.54676 3.9436 9.10288 8.66123 6.29767 12.8059 5.50658 numMergedOcc 0
32 mol 212 unq 13 iso 0 dist 8.70011 8.87823 8.69988 9.54676 3.9436 9.10288 14.4013 11.1501 7.75271 9.10095 numMergedOcc 0
33 mol 212 unq 14 iso 0 dist 8.70011 8.87823 8.69988 9.54676 3.9436 9.10288 12.2545 8.74585 4.21442 9.22129 numMergedOcc 0
34 mol 212 unq 15 iso 0 dist 8.70011 10.7245 8.55903 9.54676 3.9436 6.19798 8.66123 6.29767 10.7914 5.50658 numMergedOcc 0
35 mol 212 unq 16 iso 0 dist 8.70011 10.7245 8.55903 9.54676 3.9436 6.19798 14.4013 11.1501 4.01146 9.10095 numMergedOcc 0
36 mol 212 unq 17 iso 0 dist 8.70011 10.7245 8.55903 9.54676 3.9436 6.19798 12.2545 8.74585 6.69225 9.22129 numMergedOcc 0
37 mol 227 unq 0 iso 0 dist 9.07872 4.21811 6.02296 13.0848 5.83175 9.18728 16.8257 12.2278 12.8075 9.43618 numMergedOcc 0
38 mol 234 unq 0 iso 0 dist 7.46434 11.1213 7.32499 12.6209 13.1872 7.77911 11.2884 12.4869 9.35405 9.08151 numMergedOcc 0
39 mol 234 unq 1 iso 0 dist 7.50424 10.6488 7.32499 18.3012 13.1872 7.77911 16.7387 12.4869 9.35405 9.08151 numMergedOcc 0
