0 mol 0 unq 0 iso 0 dist 7.37981 10.169 9.23213 6.58151 6.26831 4.04089 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.37981 11.9257 8.81979 6.58151 6.26831 7.56754 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 7.19621 11.8799 9.23213 8.69991 6.26831 4.04089 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.19621 5.13546 8.81979 8.69991 6.26831 7.56754 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 9.69454 8.47464 6.00439 4.20374 7.48847 6.34272 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 8.42445 10.453 8.71128 10.9798 6.34525 14.3491 numMergedOcc 0
6 mol 126 unq 0 iso 0 dist 9.54928 13.0595 7.75534 12.3511 9.46588 5.83002 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 8.97145 10.4276 6.91348 13.3078 9.29384 6.01893 numMergedOcc 0
8 mol 131 unq 1 iso 0 dist 8.97145 14.8011 9.51418 13.3078 9.29384 15.1974 numMergedOcc 0
9 mol 131 unq 2 iso 0 dist 6.5874 4.96935 6.91348 10.6416 9.29384 6.01893 numMergedOcc 0
10 mol 131 unq 3 iso 0 dist 6.5874 7.83921 9.51418 10.6416 9.29384 15.1974 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 6.42756 9.82776 6.93652 8.81081 6.69515 8.00633 numMergedOcc 0
12 mol 142 unq 0 iso 0 dist 7.57458 5.81429 7.15475 9.05212 9.17106 5.14959 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 9.00898 13.7622 9.52634 11.9192 5.4969 11.4433 numMergedOcc 0
14 mol 175 unq 1 iso 0 dist 9.00898 13.7622 9.52634 11.0956 6.4318 6.38017 numMergedOcc 0
15 mol 175 unq 2 iso 0 dist 9.00898 13.7622 9.52634 15.1521 7.35824 6.05776 numMergedOcc 0
16 mol 175 unq 3 iso 0 dist 9.00898 13.7622 9.52634 13.624 9.17364 5.85047 numMergedOcc 0
17 mol 178 unq 0 iso 0 dist 8.0974 11.6559 8.96511 5.49143 4.92088 7.07052 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 7.32478 7.54928 5.48258 14.1302 8.83356 7.69247 numMergedOcc 0
19 mol 194 unq 1 iso 0 dist 7.32478 5.45144 6.15769 14.1302 8.83356 13.9521 numMergedOcc 0
20 mol 194 unq 2 iso 0 dist 9.48439 8.68698 5.48258 13.752 8.83356 7.69247 numMergedOcc 0
21 mol 194 unq 3 iso 0 dist 9.48439 10.0346 6.15769 13.752 8.83356 13.9521 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 8.49704 13.4309 6.97182 5.20422 6.38157 9.26037 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 8.49704 13.5787 6.1175 5.20422 6.38157 11.353 numMergedOcc 0
24 mol 220 unq 0 iso 0 dist 7.31105 12.3402 6.84247 12.6425 5.45036 5.49803 numMergedOcc 0
25 mol 220 unq 1 iso 0 dist 7.31105 12.3402 6.84247 12.3625 9.97586 7.44322 numMergedOcc 0
26 mol 220 unq 2 iso 0 dist 7.31105 7.84277 6.99002 12.6425 5.45036 11.2241 numMergedOcc 0
27 mol 220 unq 3 iso 0 dist 7.31105 7.84277 6.99002 12.3625 9.97586 9.68359 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 5.00515 9.90298 6.16063 10.3269 9.007 7.54397 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 9.31417 18.4149 9.29858 16.0652 7.32982 6.48619 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 5.56719 14.7671 9.29858 11.468 7.32982 6.48619 numMergedOcc 0
31 mol 253 unq 0 iso 0 dist 7.7993 14.5897 7.19465 5.75734 7.77998 14.5407 numMergedOcc 0
32 mol 253 unq 1 iso 0 dist 6.10761 8.77813 7.19465 10.1636 7.77998 14.5407 numMergedOcc 0
33 mol 257 unq 0 iso 0 dist 8.18901 9.38826 7.27505 10.5747 9.69696 5.04668 numMergedOcc 0
34 mol 257 unq 1 iso 0 dist 5.36776 9.09314 7.14834 10.6191 9.95546 5.21218 numMergedOcc 0
35 mol 272 unq 0 iso 0 dist 9.1118 11.5698 9.09992 16.9167 9.19033 11.8912 numMergedOcc 0
36 mol 272 unq 1 iso 0 dist 9.1118 11.0654 6.16449 16.9167 9.19033 6.56154 numMergedOcc 0
37 mol 274 unq 0 iso 0 dist 6.00877 4.05661 6.50589 12.8903 7.4099 12.6784 numMergedOcc 0
38 mol 274 unq 1 iso 0 dist 8.66451 7.47324 6.50589 16.0267 7.4099 12.6784 numMergedOcc 0
39 mol 282 unq 0 iso 0 dist 9.12049 5.65144 9.58517 8.9468 8.0241 5.86276 numMergedOcc 0
