0 mol 26 unq 0 iso 0 dist 5.29367 5.272 5.56136 4.87741 6.89136 7.14934 8.5973 11.1066 5.92521 8.9767 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 5.29367 5.272 5.56136 4.87741 6.89136 7.14934 7.51191 11.9576 7.97592 8.62582 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 8.07937 5.272 6.58799 14.9314 6.88695 12.7979 8.5973 12.4831 5.92521 18.3777 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 8.07937 5.272 6.58799 14.9314 6.88695 12.7979 7.51191 13.916 7.97592 20.535 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 9.49676 7.98333 12.6215 6.12182 5.73067 12.6659 4.46801 11.9552 5.17241 10.028 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 5.35101 6.89262 7.7624 7.71984 6.36193 12.9181 11.6207 15.0691 9.78668 19.2886 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 5.35101 6.89262 7.7624 4.67517 4.88613 10.671 11.6207 15.0691 9.78668 15.321 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 8.68381 6.50646 7.7624 12.5529 6.36193 12.9181 6.85539 15.0691 9.78668 19.2886 numMergedOcc 0
8 mol 58 unq 3 iso 0 dist 8.68381 6.50646 7.7624 8.47822 4.88613 10.671 6.85539 15.0691 9.78668 15.321 numMergedOcc 0
9 mol 61 unq 0 iso 0 dist 8.65313 9.97224 14.6641 8.19638 9.22002 16.7152 3.30756 11.774 9.2934 10.7865 numMergedOcc 0
10 mol 61 unq 1 iso 0 dist 8.65313 9.97224 14.6641 7.43426 7.52103 17.053 3.30756 11.774 9.2934 9.76892 numMergedOcc 0
11 mol 110 unq 0 iso 0 dist 5.36955 9.02174 6.72551 4.37283 8.181 12.2973 9.52728 11.9096 9.45247 12.9973 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 5.7232 9.18505 4.70999 8.76089 9.50322 12.7635 4.88335 8.52036 9.88156 10.3893 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 5.7232 9.18505 4.70999 6.80087 5.82404 10.4418 4.88335 8.52036 9.88156 11.323 numMergedOcc 0
14 mol 176 unq 0 iso 0 dist 9.84843 8.12047 16.5596 7.62559 8.06326 12.9652 11.1744 16.6876 7.69241 10.8316 numMergedOcc 0
15 mol 176 unq 1 iso 0 dist 9.84843 8.12047 16.5596 7.62559 8.06326 12.9652 11.8836 21.5195 8.56192 18.5196 numMergedOcc 0
16 mol 176 unq 2 iso 0 dist 9.84843 8.12047 16.5596 7.62559 8.06326 12.9652 3.52268 10.8313 7.77962 5.70936 numMergedOcc 0
17 mol 176 unq 3 iso 0 dist 9.84843 8.12047 16.5596 7.62559 8.06326 12.9652 7.39809 11.6003 8.6431 5.56553 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 6.83706 8.13376 4.77489 9.03495 6.42725 10.0766 3.94409 6.69951 8.75224 5.97386 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 9.83854 9.19106 13.5875 15.3375 7.04833 19.0698 5.12694 12.6665 5.14151 17.9289 numMergedOcc 0
20 mol 265 unq 1 iso 0 dist 6.98451 5.14122 4.86847 11.5105 9.772 13.4214 3.99477 5.8898 6.80043 7.71667 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 6.86805 7.87939 10.8888 4.97892 8.59986 12.1634 5.36106 11.7898 9.92035 7.84345 numMergedOcc 0
