0 mol 1 unq 0 iso 0 dist 7.59404 6.06669 5.55519 9.60615 5.21705 7.28542 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 7.63261 8.17979 10.1522 9.00899 10.8265 11.4319 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 7.63261 8.17979 10.1522 7.826 13.2709 5.69898 numMergedOcc 0
3 mol 27 unq 0 iso 0 dist 8.67055 9.48375 13.3383 9.40953 8.72739 17.1356 numMergedOcc 0
4 mol 27 unq 1 iso 0 dist 8.67055 9.48375 13.3383 9.57896 13.896 16.6725 numMergedOcc 0
5 mol 27 unq 2 iso 0 dist 8.67055 6.85127 9.25156 9.40953 8.72739 12.1419 numMergedOcc 0
6 mol 27 unq 3 iso 0 dist 8.67055 6.85127 9.25156 9.57896 13.896 12.5927 numMergedOcc 0
7 mol 27 unq 4 iso 0 dist 8.67055 8.58169 10.2835 9.40953 8.72739 5.68274 numMergedOcc 0
8 mol 27 unq 5 iso 0 dist 8.67055 8.58169 10.2835 9.57896 13.896 5.5733 numMergedOcc 0
9 mol 27 unq 6 iso 0 dist 6.25236 9.48375 12.6088 9.40953 5.02694 17.1356 numMergedOcc 0
10 mol 27 unq 7 iso 0 dist 6.25236 9.48375 12.6088 9.57896 9.03463 16.6725 numMergedOcc 0
11 mol 27 unq 8 iso 0 dist 6.25236 6.85127 7.63122 9.40953 5.02694 12.1419 numMergedOcc 0
12 mol 27 unq 9 iso 0 dist 6.25236 6.85127 7.63122 9.57896 9.03463 12.5927 numMergedOcc 0
13 mol 27 unq 10 iso 0 dist 6.25236 8.58169 5.48316 9.40953 5.02694 5.68274 numMergedOcc 0
14 mol 27 unq 11 iso 0 dist 6.25236 8.58169 5.48316 9.57896 9.03463 5.5733 numMergedOcc 0
15 mol 43 unq 0 iso 0 dist 6.38662 8.83248 6.95983 9.4658 4.89928 7.20713 numMergedOcc 0
16 mol 53 unq 0 iso 0 dist 8.61714 7.57227 8.86892 7.27048 6.65221 5.38541 numMergedOcc 0
17 mol 61 unq 0 iso 0 dist 9.68759 9.72716 16.3994 9.65903 13.6916 9.97259 numMergedOcc 0
18 mol 71 unq 0 iso 0 dist 8.58853 5.75102 4.29097 5.21993 8.22454 7.82219 numMergedOcc 0
19 mol 103 unq 0 iso 0 dist 8.60361 5.72494 11.1242 9.43076 11.4521 4.78648 numMergedOcc 0
20 mol 103 unq 1 iso 0 dist 8.60361 8.70106 15.0192 9.43076 11.4521 10.6434 numMergedOcc 0
21 mol 122 unq 0 iso 0 dist 4.38961 6.78551 6.25432 7.34585 3.65582 9.61656 numMergedOcc 0
22 mol 148 unq 0 iso 0 dist 8.6499 8.60157 14.6035 9.8506 13.5761 16.0449 numMergedOcc 0
23 mol 148 unq 1 iso 0 dist 8.6499 6.72591 14.778 9.8506 13.5761 8.01366 numMergedOcc 0
24 mol 150 unq 0 iso 0 dist 8.75339 8.59359 14.6751 9.91991 13.6344 16.1293 numMergedOcc 0
25 mol 150 unq 1 iso 0 dist 8.75339 6.80192 14.922 9.91991 13.6344 8.04136 numMergedOcc 0
26 mol 167 unq 0 iso 0 dist 9.8024 6.6514 11.1988 5.57495 11.8945 8.23378 numMergedOcc 0
27 mol 167 unq 1 iso 0 dist 9.8024 6.6514 11.1988 9.38297 18.1675 12.2546 numMergedOcc 0
28 mol 180 unq 0 iso 0 dist 7.36717 9.46309 6.02936 9.80157 4.71622 5.83274 numMergedOcc 0
29 mol 214 unq 0 iso 0 dist 6.22499 9.66533 9.18058 8.70011 9.75492 10.0389 numMergedOcc 0
30 mol 233 unq 0 iso 0 dist 8.69185 7.5099 8.42399 9.28828 6.37079 7.79921 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 6.37648 9.33299 6.20477 7.8428 4.83781 10.9358 numMergedOcc 0
32 mol 259 unq 1 iso 0 dist 6.37648 9.49732 10.1526 7.8428 4.83781 6.51653 numMergedOcc 0
33 mol 278 unq 0 iso 0 dist 8.31953 9.48559 11.2255 5.74676 3.86293 7.65985 numMergedOcc 0
34 mol 284 unq 0 iso 0 dist 9.00473 9.75137 8.61012 7.21255 9.60012 13.9708 numMergedOcc 0
