0 mol 24 unq 0 iso 0 dist 9.54519 6.36381 5.50396 13.2653 5.54419 9.33482 8.6586 6.7846 3.67206 8.23075 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.54519 6.36381 5.50396 13.2653 5.54419 9.33482 13.2236 8.03955 8.93303 4.7841 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 9.87281 8.27137 14.1577 6.17631 7.31767 11.4732 11.3003 7.23535 12.3528 7.03372 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 7.63928 8.27137 14.321 6.17631 6.03987 11.4732 11.3003 9.92243 12.3528 7.03372 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 6.88695 9.63803 8.25132 5.3315 8.34347 13.6027 11.2671 12.5438 15.678 7.98005 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 6.88695 9.63803 8.25132 5.3315 8.34347 13.6027 7.89667 8.39015 8.86888 8.31381 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.4551 6.63973 6.77898 8.78063 6.97941 9.76346 6.46582 3.69293 3.35924 7.61521 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 6.31125 9.10434 3.98662 5.59449 6.85062 10.7579 13.8709 11.6692 14.9765 8.80895 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 8.7366 9.98509 4.04586 4.90475 7.7059 9.64688 9.44592 6.85721 7.39388 5.77186 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 8.07256 9.81212 7.68889 10.4039 8.56324 15.817 14.986 9.73449 16.9838 7.55934 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 6.752 6.41148 8.67921 4.2475 7.45763 6.49765 8.93485 5.42503 6.49396 9.31158 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 5.4913 5.06713 8.67921 6.8901 7.45763 6.49765 5.66636 5.42503 6.49396 9.31158 numMergedOcc 0
12 mol 205 unq 2 iso 0 dist 5.4913 8.69512 12.8695 6.8901 7.45763 14.2129 5.66636 5.42503 8.93955 9.31158 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 7.85877 8.86886 8.34852 4.82768 7.21333 12.0171 4.90656 8.89157 10.1968 5.1609 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 9.71801 7.15079 11.4471 5.9882 7.56915 11.9912 11.8576 4.24652 13.7167 9.83622 numMergedOcc 0
15 mol 292 unq 0 iso 0 dist 9.30668 5.72473 7.8414 8.04474 8.2734 7.20674 11.1568 4.02751 8.76061 6.69619 numMergedOcc 0
16 mol 292 unq 1 iso 0 dist 9.30668 5.72473 7.8414 8.04474 8.2734 7.20674 10.2196 5.99797 9.42231 4.49592 numMergedOcc 0
