0 mol 122 unq 0 iso 0 dist 9.21665 8.68384 13.4677 8.58081 6.97281 8.13856 7.69764 14.791 9.00365 13.5439 numMergedOcc 0
1 mol 125 unq 0 iso 0 dist 6.6081 8.75402 4.77979 9.93888 6.06801 6.26399 10.6764 9.64304 8.48363 14.351 numMergedOcc 0
2 mol 134 unq 0 iso 0 dist 7.94564 6.00896 6.01484 6.41759 4.77133 7.45747 10.0801 14.1149 8.15734 14.5842 numMergedOcc 0
3 mol 134 unq 1 iso 0 dist 9.21999 6.00896 10.6104 6.41759 4.56331 7.45747 10.0801 18.1155 8.15734 14.5842 numMergedOcc 0
4 mol 193 unq 0 iso 0 dist 9.16852 7.71716 3.53549 8.28942 9.98298 7.03555 13.1729 5.19654 8.71993 14.8267 numMergedOcc 0
5 mol 205 unq 0 iso 0 dist 8.21112 6.02053 8.82544 7.18098 11.3947 3.73699 4.4482 7.06533 7.41663 10.1621 numMergedOcc 0
6 mol 209 unq 0 iso 0 dist 7.757 8.20431 5.86856 9.73136 5.58598 5.3027 9.5473 12.9945 8.12326 11.6272 numMergedOcc 0
7 mol 209 unq 1 iso 0 dist 7.757 8.20431 5.86856 9.73136 5.58598 5.3027 5.35106 10.2873 7.37014 11.129 numMergedOcc 0
8 mol 209 unq 2 iso 0 dist 7.757 8.8886 8.13817 9.73136 5.58598 5.01087 6.11542 9.56015 8.78565 11.5455 numMergedOcc 0
9 mol 239 unq 0 iso 0 dist 8.33254 8.92121 11.8831 8.03092 14.4546 11.1207 7.19561 13.9272 9.95252 11.8674 numMergedOcc 0
10 mol 261 unq 0 iso 0 dist 8.64393 6.99444 7.70154 9.4157 5.01937 4.64981 10.4134 16.2083 9.38192 13.3374 numMergedOcc 0
11 mol 267 unq 0 iso 0 dist 5.32643 6.79491 9.17078 4.42902 4.74052 6.15683 7.06028 11.366 5.72144 9.56478 numMergedOcc 0
12 mol 273 unq 0 iso 0 dist 9.36052 7.84151 10.402 8.28809 6.08276 8.8839 6.91672 13.5125 7.346 13.5107 numMergedOcc 0
13 mol 279 unq 0 iso 0 dist 8.87355 8.52827 10.2078 9.44618 5.10922 13.4439 7.00034 8.18179 7.14122 11.929 numMergedOcc 0
