0 mol 16 unq 0 iso 0 dist 9.15471 5.61445 9.30471 8.82587 6.88552 5.05803 5.11248 9.78197 5.30082 6.93532 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 5.45684 11.6779 8.75668 11.8671 7.26966 9.67592 6.11938 5.94373 6.21578 9.97159 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 7.76644 10.1207 8.75668 10.9973 7.26966 9.67592 4.43442 5.94373 6.21578 9.97159 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 7.93145 9.14798 6.96759 16.1633 13.8905 7.79912 15.6758 18.043 11.4997 9.81166 numMergedOcc 0
4 mol 129 unq 0 iso 0 dist 7.26325 6.65856 6.42706 6.23966 5.12351 5.83384 6.47522 9.51709 4.55551 6.28565 numMergedOcc 0
5 mol 129 unq 1 iso 0 dist 7.26325 6.65856 6.42706 6.23966 5.12351 5.83384 5.85167 11.1555 10.5488 7.58957 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 5.92836 14.5299 9.47554 10.1767 5.34829 7.11802 9.79624 10.1132 16.0138 9.22232 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 5.92836 14.5299 9.47554 10.1767 5.34829 7.11802 16.5312 10.7163 5.92062 9.22661 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 5.92836 14.5299 9.47554 10.1767 5.34829 7.11802 17.6068 12.2027 6.61891 7.56378 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 9.23669 15.0515 9.44947 15.8109 10.2677 8.51516 10.389 7.59757 5.86489 7.32294 numMergedOcc 0
10 mol 209 unq 0 iso 0 dist 8.8886 11.2558 9.62543 10.795 8.42394 7.56373 5.54278 8.76128 6.552 6.85935 numMergedOcc 0
11 mol 209 unq 1 iso 0 dist 8.78565 12.9345 9.62543 14.4808 8.42394 7.56373 9.814 8.76128 6.552 6.85935 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 9.57625 13.0808 5.39218 20.4393 13.3213 9.23153 15.1504 10.6444 7.11498 6.59716 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 7.75366 10.1036 4.80834 13.6759 7.04671 5.72887 21.398 15.6369 14.7883 9.24557 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.73425 5.13233 9.04358 10.7821 8.81588 6.60405 9.76914 13.3737 5.63675 7.21311 numMergedOcc 0
