0 mol 16 unq 0 iso 0 dist 9.76968 4.2139 6.31718 12.1682 5.45161 8.33883 9.68387 10.4366 6.93532 10.2885 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 7.7978 6.8958 7.17396 5.70814 6.34264 6.48625 12.9886 6.90592 8.08618 9.97686 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 9.55751 5.85228 7.17396 5.58384 6.34264 6.48625 13.0785 6.90592 8.08618 9.97686 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 5.58346 5.2774 6.89722 9.54477 6.56633 9.24757 11.5412 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.18305 4.69583 6.19304 9.10386 5.44275 7.26679 9.54477 6.56633 9.24757 11.2253 numMergedOcc 0
5 mol 126 unq 0 iso 0 dist 8.32241 4.84035 6.06638 12.7621 9.07346 9.06961 8.97111 6.0268 6.30546 4.43093 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 6.31125 5.59449 6.85062 14.524 14.257 8.97145 13.6954 14.2045 8.70296 4.17212 numMergedOcc 0
7 mol 131 unq 1 iso 0 dist 6.31125 5.59449 6.85062 14.524 14.257 8.97145 10.9811 5.09131 9.25558 13.6005 numMergedOcc 0
8 mol 131 unq 2 iso 0 dist 6.31125 5.59449 6.85062 10.9705 7.60371 6.5874 13.6954 14.2045 8.70296 9.64263 numMergedOcc 0
9 mol 131 unq 3 iso 0 dist 6.31125 5.59449 6.85062 10.9705 7.60371 6.5874 10.9811 5.09131 9.25558 5.55307 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 5.82404 4.64588 6.80239 6.23615 7.96098 6.11955 6.72323 4.54648 5.87634 4.7146 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 6.752 4.2475 7.45763 10.7582 10.6123 8.43584 7.23557 5.8535 4.8668 5.42117 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 5.4913 6.8901 7.45763 13.5379 10.6123 8.43584 8.86587 5.8535 4.8668 5.42117 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 8.62103 3.84723 6.18308 9.97171 5.82028 9.67457 10.7279 5.87279 7.10826 11.6718 numMergedOcc 0
14 mol 229 unq 0 iso 0 dist 8.6537 8.65216 8.22528 17.1493 11.9226 9.84492 9.38362 6.65022 8.66332 10.8309 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 9.94315 12.521 5.72887 15.9247 6.62361 9.31417 20.4128 14.7883 9.24557 16.7165 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 9.94315 12.521 5.72887 15.6563 5.96552 5.56719 20.4128 14.7883 9.24557 11.9863 numMergedOcc 0
17 mol 238 unq 2 iso 0 dist 8.59074 9.18011 5.72887 14.2562 6.62361 9.31417 16.6167 14.7883 9.24557 16.7165 numMergedOcc 0
18 mol 238 unq 3 iso 0 dist 8.59074 9.18011 5.72887 13.2039 5.96552 5.56719 16.6167 14.7883 9.24557 11.9863 numMergedOcc 0
19 mol 238 unq 4 iso 0 dist 6.2365 4.7157 5.72887 9.91921 6.62361 9.31417 12.6054 14.7883 9.24557 16.7165 numMergedOcc 0
20 mol 238 unq 5 iso 0 dist 6.2365 4.7157 5.72887 8.20243 5.96552 5.56719 12.6054 14.7883 9.24557 11.9863 numMergedOcc 0
21 mol 241 unq 0 iso 0 dist 8.40773 6.72492 7.4631 12.3126 4.86437 9.72526 10.5164 4.45049 7.89524 7.18308 numMergedOcc 0
22 mol 241 unq 1 iso 0 dist 9.18476 9.87799 7.4631 8.15897 4.86437 9.72526 12.949 4.45049 7.89524 7.18308 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 8.43858 8.55312 6.24356 13.3031 10.0289 6.75305 13.7665 7.52936 5.93616 6.28052 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 9.71801 5.9882 7.56915 15.4711 10.7962 9.696 9.02071 6.20558 9.85289 14.679 numMergedOcc 0
