0 mol 0 unq 0 iso 0 dist 9.42137 6.99594 10.3034 3.68241 11.8368 5.75315 numMergedOcc 0
1 mol 1 unq 0 iso 0 dist 6.4181 7.90928 5.11735 5.06184 6.86701 5.96833 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 6.88695 9.97117 7.23546 12.2008 14.8317 9.96121 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 5.41493 6.0961 5.0364 12.6048 11.3157 7.29079 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 8.05508 8.17564 14.134 10.8351 14.0887 8.67634 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 9.00229 8.17564 14.9359 10.8351 19.7536 8.67634 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 8.1599 8.84323 5.49555 5.46563 6.9103 9.1062 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 9.46247 5.70192 10.331 3.77705 8.3733 8.96498 numMergedOcc 0
8 mol 67 unq 1 iso 0 dist 9.46247 5.70192 10.331 11.7466 17.7629 7.5228 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 9.71952 8.6411 7.18506 6.69911 8.13108 9.40363 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 7.28257 8.94956 7.18506 3.94216 8.13108 9.40363 numMergedOcc 0
11 mol 78 unq 0 iso 0 dist 9.44916 9.4909 5.7835 11.0011 10.8443 5.47706 numMergedOcc 0
12 mol 78 unq 1 iso 0 dist 9.44916 9.4909 5.7835 10.0477 10.36 8.89842 numMergedOcc 0
13 mol 78 unq 2 iso 0 dist 9.44916 9.4909 5.7835 16.0481 12.989 8.07568 numMergedOcc 0
14 mol 88 unq 0 iso 0 dist 9.72689 6.98838 5.90098 7.32542 10.2942 5.28732 numMergedOcc 0
15 mol 115 unq 0 iso 0 dist 6.48328 5.58063 4.51489 8.29196 11.8574 7.65255 numMergedOcc 0
16 mol 117 unq 0 iso 0 dist 6.90827 9.58171 4.91401 5.61881 8.84018 9.94053 numMergedOcc 0
17 mol 159 unq 0 iso 0 dist 7.97007 8.94941 6.49376 9.84064 13.15 8.88492 numMergedOcc 0
18 mol 173 unq 0 iso 0 dist 8.1088 9.56248 13.5291 15.8873 20.246 8.62366 numMergedOcc 0
19 mol 173 unq 1 iso 0 dist 8.1088 9.56248 13.5291 14.9274 21.284 9.44973 numMergedOcc 0
20 mol 173 unq 2 iso 0 dist 8.1088 9.56248 13.5291 9.35913 15.2664 6.52508 numMergedOcc 0
21 mol 175 unq 0 iso 0 dist 8.58906 9.00025 13.909 4.6563 13.1336 9.65629 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 9.84952 6.17129 6.7991 7.19461 6.64173 9.09234 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 9.84952 6.17129 6.7991 9.77747 9.01624 6.76746 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 9.84952 6.17129 6.7991 10.0615 9.55105 8.92098 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 7.41378 5.83596 8.35755 11.195 15.3823 9.09234 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 7.41378 5.83596 8.35755 4.76079 5.05973 6.76746 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 7.41378 5.83596 8.35755 6.38851 8.40951 8.92098 numMergedOcc 0
28 mol 214 unq 0 iso 0 dist 4.84709 9.39099 10.7373 9.75492 13.9627 9.58372 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 6.24928 8.81534 6.20606 16.1646 14.7404 9.38131 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 8.59074 9.46582 13.7993 5.17342 8.923 7.39547 numMergedOcc 0
31 mol 243 unq 0 iso 0 dist 6.86162 7.77265 5.70464 8.61196 12.3379 9.33476 numMergedOcc 0
32 mol 270 unq 0 iso 0 dist 7.82003 8.76013 10.4895 12.5153 15.074 9.51462 numMergedOcc 0
33 mol 270 unq 1 iso 0 dist 7.82003 8.76013 10.4895 6.27469 11.6697 8.12971 numMergedOcc 0
