0 mol 24 unq 0 iso 0 dist 9.01567 7.33768 7.88693 13.0212 8.49709 12.7215 11.1214 6.25108 7.72688 6.01284 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.01567 7.29868 6.16544 13.0212 8.49709 12.9064 11.1214 6.25108 11.8207 6.01284 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.4051 8.23446 14.1082 13.6174 5.80953 17.4861 11.2485 6.99746 16.78 8.24948 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 8.4051 8.75662 9.62033 13.6174 5.80953 11.7489 11.2485 6.99746 7.05541 8.24948 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 7.29868 7.33768 10.2653 5.69214 5.80953 10.8435 10.7114 6.99746 10.025 8.24948 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 7.29868 9.01567 6.16544 5.69214 5.80953 10.8068 10.7114 6.99746 9.14963 8.24948 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 8.60554 8.44664 14.1496 5.11636 5.80953 12.8213 6.72502 6.99746 7.6844 8.24948 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 8.60554 9.44691 9.62033 5.11636 5.80953 11.7489 6.72502 6.99746 7.05541 8.24948 numMergedOcc 0
8 mol 24 unq 8 iso 0 dist 8.23446 8.4051 14.1082 5.50396 4.44526 9.84204 11.9933 9.22115 11.8996 7.96195 numMergedOcc 0
9 mol 24 unq 9 iso 0 dist 8.23446 8.75662 11.342 5.50396 4.44526 9.586 11.9933 9.22115 9.15493 7.96195 numMergedOcc 0
10 mol 24 unq 10 iso 0 dist 8.75662 8.4051 9.62033 5.50396 9.586 9.84204 11.9933 9.15493 11.8996 7.96195 numMergedOcc 0
11 mol 24 unq 11 iso 0 dist 8.75662 8.23446 11.342 5.50396 9.586 4.44526 11.9933 9.15493 9.22115 7.96195 numMergedOcc 0
12 mol 24 unq 12 iso 0 dist 9.44691 8.60554 9.62033 14.4081 9.586 9.84204 10.9839 9.15493 11.8996 7.96195 numMergedOcc 0
13 mol 24 unq 13 iso 0 dist 9.44691 8.44664 10.4263 14.4081 9.586 19.2261 10.9839 9.15493 16.3656 7.96195 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 7.78652 8.91301 4.30566 4.78563 5.06564 7.5373 7.25673 6.60479 7.54337 8.612 numMergedOcc 0
15 mol 143 unq 1 iso 0 dist 8.91301 7.78652 4.30566 4.78563 7.5373 5.06564 7.25673 7.54337 6.60479 8.612 numMergedOcc 0
16 mol 159 unq 0 iso 0 dist 8.4858 9.17787 7.73341 4.48323 9.35202 12.5346 7.25742 7.97232 10.3427 6.07821 numMergedOcc 0
17 mol 170 unq 0 iso 0 dist 6.35982 7.51126 6.24983 4.78249 6.47164 9.65126 8.15099 7.29587 8.73585 5.13268 numMergedOcc 0
18 mol 170 unq 1 iso 0 dist 7.51126 6.35982 6.24983 4.78249 9.65126 6.47164 8.15099 8.73585 7.29587 5.13268 numMergedOcc 0
19 mol 188 unq 0 iso 0 dist 7.14503 8.10214 9.01338 9.71636 8.66624 11.506 8.57261 5.0782 5.87427 7.79115 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 6.72379 8.29382 6.7294 4.66791 9.00322 11.2491 8.83356 7.50057 12.361 6.72182 numMergedOcc 0
21 mol 195 unq 0 iso 0 dist 7.36683 6.95086 9.90317 5.41635 6.22742 10.8593 6.60567 6.0634 6.74112 6.34234 numMergedOcc 0
22 mol 212 unq 0 iso 0 dist 8.69988 9.74144 12.5482 3.9436 9.10288 12.0526 6.29767 12.8059 9.75095 5.50658 numMergedOcc 0
23 mol 212 unq 1 iso 0 dist 8.69988 9.74144 12.5482 3.9436 9.10288 12.0526 11.1501 7.75271 18.4682 9.10095 numMergedOcc 0
24 mol 212 unq 2 iso 0 dist 8.69988 9.74144 12.5482 3.9436 9.10288 12.0526 8.74585 4.21442 15.1535 9.22129 numMergedOcc 0
25 mol 212 unq 3 iso 0 dist 8.69988 8.55903 6.18191 3.9436 9.10288 6.19798 6.29767 12.8059 10.7914 5.50658 numMergedOcc 0
26 mol 212 unq 4 iso 0 dist 8.69988 8.55903 6.18191 3.9436 9.10288 6.19798 11.1501 7.75271 4.01146 9.10095 numMergedOcc 0
27 mol 212 unq 5 iso 0 dist 8.69988 8.55903 6.18191 3.9436 9.10288 6.19798 8.74585 4.21442 6.69225 9.22129 numMergedOcc 0
28 mol 212 unq 6 iso 0 dist 8.69988 7.15603 7.34372 3.9436 9.10288 9.32123 6.29767 12.8059 9.63281 5.50658 numMergedOcc 0
29 mol 212 unq 7 iso 0 dist 8.69988 7.15603 7.34372 3.9436 9.10288 9.32123 11.1501 7.75271 13.8159 9.10095 numMergedOcc 0
30 mol 212 unq 8 iso 0 dist 8.69988 7.15603 7.34372 3.9436 9.10288 9.32123 8.74585 4.21442 10.1399 9.22129 numMergedOcc 0
31 mol 212 unq 9 iso 0 dist 8.55903 9.74144 15.0034 3.9436 6.19798 12.0526 6.29767 10.7914 9.75095 5.50658 numMergedOcc 0
32 mol 212 unq 10 iso 0 dist 8.55903 9.74144 15.0034 3.9436 6.19798 12.0526 11.1501 4.01146 18.4682 9.10095 numMergedOcc 0
33 mol 212 unq 11 iso 0 dist 8.55903 9.74144 15.0034 3.9436 6.19798 12.0526 8.74585 6.69225 15.1535 9.22129 numMergedOcc 0
34 mol 212 unq 12 iso 0 dist 8.55903 8.69988 6.18191 3.9436 6.19798 9.10288 6.29767 10.7914 12.8059 5.50658 numMergedOcc 0
35 mol 212 unq 13 iso 0 dist 8.55903 8.69988 6.18191 3.9436 6.19798 9.10288 11.1501 4.01146 7.75271 9.10095 numMergedOcc 0
36 mol 212 unq 14 iso 0 dist 8.55903 8.69988 6.18191 3.9436 6.19798 9.10288 8.74585 6.69225 4.21442 9.22129 numMergedOcc 0
37 mol 212 unq 15 iso 0 dist 8.55903 7.15603 10.7093 3.9436 6.19798 9.32123 6.29767 10.7914 9.63281 5.50658 numMergedOcc 0
38 mol 212 unq 16 iso 0 dist 8.55903 7.15603 10.7093 3.9436 6.19798 9.32123 11.1501 4.01146 13.8159 9.10095 numMergedOcc 0
39 mol 212 unq 17 iso 0 dist 8.55903 7.15603 10.7093 3.9436 6.19798 9.32123 8.74585 6.69225 10.1399 9.22129 numMergedOcc 0
40 mol 227 unq 0 iso 0 dist 7.43071 5.41321 11.362 5.0317 9.18728 8.91971 8.03442 12.8075 4.59123 9.43618 numMergedOcc 0
41 mol 227 unq 1 iso 0 dist 5.41321 7.43071 11.362 5.0317 8.91971 9.18728 8.03442 4.59123 12.8075 9.43618 numMergedOcc 0
42 mol 234 unq 0 iso 0 dist 7.32499 6.30154 10.0708 13.1872 7.77911 14.1037 12.4869 9.35405 9.45269 9.08151 numMergedOcc 0
