REMARK Name = BDB000723 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.484 2.630 -2.149 0.00 0.00 +0.008 C ATOM 2 C LIG 1 -1.816 2.635 -1.969 0.00 0.00 +0.009 C ENDROOT BRANCH 1 6 ATOM 3 C LIG 1 2.357 -0.332 -0.916 0.00 0.00 +0.121 A ATOM 4 C LIG 1 1.244 -0.699 -1.676 0.00 0.00 +0.046 A ATOM 5 C LIG 1 0.308 0.256 -2.083 0.00 0.00 +0.011 A ATOM 6 C LIG 1 0.466 1.596 -1.722 0.00 0.00 -0.025 A ATOM 7 C LIG 1 1.586 1.966 -0.969 0.00 0.00 +0.011 A ATOM 8 C LIG 1 2.523 1.007 -0.563 0.00 0.00 +0.046 A BRANCH 3 9 ATOM 9 O LIG 1 3.184 -1.368 -0.586 0.00 0.00 -0.492 OA BRANCH 9 10 ATOM 10 C LIG 1 4.397 -1.087 0.114 0.00 0.00 +0.229 C BRANCH 10 11 ATOM 11 C LIG 1 4.158 -1.086 1.623 0.00 0.00 +0.041 C BRANCH 11 13 ATOM 12 C LIG 1 6.071 0.464 2.274 0.00 0.00 +0.004 C ATOM 13 C LIG 1 5.435 -0.908 2.442 0.00 0.00 -0.000 C ENDBRANCH 11 13 ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 3 9 ENDBRANCH 1 6 BRANCH 2 14 ATOM 14 C LIG 1 -2.620 1.631 -1.263 0.00 0.00 -0.018 A ATOM 15 C LIG 1 -2.343 1.258 0.056 0.00 0.00 +0.053 A ATOM 16 C LIG 1 -3.134 0.313 0.715 0.00 0.00 +0.124 A ATOM 17 C LIG 1 -4.225 -0.257 0.054 0.00 0.00 +0.091 A ATOM 18 C LIG 1 -4.523 0.117 -1.260 0.00 0.00 +0.124 A ATOM 19 C LIG 1 -3.723 1.063 -1.908 0.00 0.00 +0.053 A BRANCH 16 20 ATOM 20 O LIG 1 -2.741 0.043 1.999 0.00 0.00 -0.495 OA ATOM 21 C LIG 1 -3.452 -0.972 2.695 0.00 0.00 +0.277 C ENDBRANCH 16 20 BRANCH 18 22 ATOM 22 O LIG 1 -5.561 -0.358 -2.016 0.00 0.00 -0.495 OA ATOM 23 C LIG 1 -6.402 -1.337 -1.420 0.00 0.00 +0.277 C ENDBRANCH 18 22 ENDBRANCH 2 14 TORSDOF 8