0 mol 14 unq 0 iso 0 dist 7.59564 6.24146 7.73217 6.30573 4.75873 9.04767 5.91419 12.1635 11.3111 8.60571 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 8.10957 4.81121 8.82819 6.30573 6.03847 9.7022 5.91419 11.6604 7.12085 8.60571 numMergedOcc 0
2 mol 14 unq 2 iso 0 dist 8.10957 7.95811 5.36937 6.30573 6.03847 9.58196 5.91419 11.6604 10.9516 8.60571 numMergedOcc 0
3 mol 14 unq 3 iso 0 dist 8.10957 6.24146 5.99703 6.30573 6.03847 9.04767 5.91419 11.6604 11.3111 8.60571 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.84944 14.9082 8.03754 22.5146 14.0204 8.80331 17.3211 10.5084 5.90113 9.17086 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 7.21995 4.80528 8.03754 12.8866 14.0204 8.80331 6.06265 10.5084 5.90113 9.17086 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.90896 18.2252 9.41049 12.8368 4.60412 5.93252 15.8227 9.63452 8.3449 6.10011 numMergedOcc 0
7 mol 75 unq 0 iso 0 dist 8.25597 5.56574 9.20448 13.0751 14.2474 7.79912 18.5749 21.8212 13.5815 8.2147 numMergedOcc 0
8 mol 75 unq 1 iso 0 dist 4.76466 5.56574 6.96759 13.0751 13.8905 7.79912 18.5749 20.4429 13.5815 8.2147 numMergedOcc 0
9 mol 75 unq 2 iso 0 dist 8.67172 5.56574 6.97318 13.0751 11.2774 7.79912 18.5749 18.4305 13.5815 8.2147 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 9.33293 9.48465 7.9258 16.9836 10.9791 9.33865 19.2905 17.3785 11.8721 8.97043 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 9.52061 5.99695 8.59695 10.482 6.13737 5.83384 11.4044 10.6541 6.65856 6.23966 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 9.61101 6.29782 6.42706 10.514 5.12351 5.83384 6.64929 7.26325 6.65856 6.23966 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 6.23677 6.87755 7.49783 12.2287 12.8561 8.95269 15.2478 19.2092 14.1073 9.73411 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 6.23677 6.87755 7.49783 12.2287 12.8561 8.95269 10.8164 12.1661 11.8217 7.07564 numMergedOcc 0
15 mol 224 unq 2 iso 0 dist 9.04741 12.3271 7.49783 16.6527 12.8561 8.95269 18.6978 19.2092 14.1073 9.73411 numMergedOcc 0
16 mol 224 unq 3 iso 0 dist 9.04741 12.3271 7.49783 16.6527 12.8561 8.95269 13.0697 12.1661 11.8217 7.07564 numMergedOcc 0
17 mol 224 unq 4 iso 0 dist 7.31608 11.0252 7.49783 12.7763 12.8561 8.95269 16.6993 19.2092 14.1073 9.73411 numMergedOcc 0
18 mol 224 unq 5 iso 0 dist 7.31608 11.0252 7.49783 12.7763 12.8561 8.95269 8.30109 12.1661 11.8217 7.07564 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 6.33567 6.51074 7.69358 10.3219 9.80642 6.97229 15.4013 16.9323 10.4505 8.44862 numMergedOcc 0
20 mol 258 unq 1 iso 0 dist 8.10903 9.78068 9.04358 8.81059 5.90131 6.42289 5.79358 8.73425 5.13233 8.21585 numMergedOcc 0
21 mol 261 unq 0 iso 0 dist 8.88741 6.5875 7.30472 7.15785 6.43209 8.02547 5.72823 11.9931 5.79827 9.95681 numMergedOcc 0
22 mol 261 unq 1 iso 0 dist 8.88741 6.5875 7.30472 9.43169 7.78464 6.05727 5.72823 11.9931 5.79827 9.05762 numMergedOcc 0
23 mol 280 unq 0 iso 0 dist 4.45141 6.07005 5.41639 10.6192 8.26589 6.53701 5.846 6.38295 8.30978 8.80588 numMergedOcc 0
24 mol 280 unq 1 iso 0 dist 4.45141 7.38048 7.96485 10.6192 8.26589 6.0664 5.846 6.38295 5.80223 8.80588 numMergedOcc 0
