REMARK Name = BDB024032 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -1.467 1.182 1.059 0.00 0.00 +0.047 A ATOM 2 C LIG 1 -1.490 2.576 1.072 0.00 0.00 +0.134 A ATOM 3 F LIG 1 -0.921 3.244 2.084 0.00 0.00 -0.205 F ATOM 4 C LIG 1 -2.083 3.306 0.047 0.00 0.00 +0.039 A ATOM 5 C LIG 1 -2.689 2.641 -1.016 0.00 0.00 +0.007 A ATOM 6 C LIG 1 -2.720 1.240 -1.045 0.00 0.00 -0.041 A ATOM 7 C LIG 1 -2.094 0.524 -0.009 0.00 0.00 +0.018 A ENDROOT BRANCH 1 11 ATOM 8 N LIG 1 2.198 -0.672 1.815 0.00 0.00 -0.299 N ATOM 9 C LIG 1 1.948 0.071 3.047 0.00 0.00 +0.116 C ATOM 10 C LIG 1 0.871 1.109 2.809 0.00 0.00 +0.093 C ATOM 11 P LIG 1 -0.702 0.315 2.397 0.00 0.00 +0.122 P ATOM 12 O LIG 1 -1.563 0.188 3.631 0.00 0.00 -0.316 OA ATOM 13 C LIG 1 -0.169 -1.339 1.893 0.00 0.00 +0.093 C ATOM 14 C LIG 1 1.093 -1.260 1.059 0.00 0.00 +0.116 C BRANCH 8 18 ATOM 15 C LIG 1 5.582 0.201 -0.394 0.00 0.00 -0.011 A ATOM 16 C LIG 1 5.371 0.693 0.872 0.00 0.00 +0.119 A ATOM 17 N LIG 1 4.273 0.428 1.607 0.00 0.00 -0.222 NA ATOM 18 C LIG 1 3.335 -0.371 1.075 0.00 0.00 +0.218 A ATOM 19 N LIG 1 3.460 -0.898 -0.155 0.00 0.00 -0.222 NA ATOM 20 C LIG 1 4.573 -0.609 -0.857 0.00 0.00 +0.119 A BRANCH 15 21 ATOM 21 C LIG 1 6.820 0.490 -1.183 0.00 0.00 +0.038 C BRANCH 21 23 ATOM 22 C LIG 1 9.176 -0.230 -1.712 0.00 0.00 +0.004 C ATOM 23 C LIG 1 7.923 -0.532 -0.905 0.00 0.00 +0.001 C ENDBRANCH 21 23 ENDBRANCH 15 21 ENDBRANCH 8 18 ENDBRANCH 1 11 BRANCH 6 24 ATOM 24 C LIG 1 -3.370 0.525 -2.209 0.00 0.00 +0.093 C BRANCH 24 25 ATOM 25 C LIG 1 -4.208 -0.681 -1.804 0.00 0.00 +0.074 A ATOM 26 C LIG 1 -5.555 -0.487 -1.209 0.00 0.00 +0.011 A ATOM 27 C LIG 1 -6.268 -1.634 -0.863 0.00 0.00 +0.050 A ATOM 28 C LIG 1 -7.545 -1.538 -0.296 0.00 0.00 +0.014 A ATOM 29 C LIG 1 -8.110 -0.284 -0.073 0.00 0.00 +0.001 A ATOM 30 C LIG 1 -7.402 0.868 -0.415 0.00 0.00 +0.001 A ATOM 31 C LIG 1 -5.662 -2.954 -1.098 0.00 0.00 +0.272 A ATOM 32 O LIG 1 -6.256 -3.991 -0.821 0.00 0.00 -0.266 OA ATOM 33 N LIG 1 -4.402 -2.953 -1.643 0.00 0.00 -0.242 N ATOM 34 H LIG 1 -3.973 -3.857 -1.817 0.00 0.00 +0.192 HD ATOM 35 C LIG 1 -6.128 0.770 -0.982 0.00 0.00 +0.010 A ATOM 36 N LIG 1 -3.681 -1.856 -1.996 0.00 0.00 -0.175 NA ENDBRANCH 24 25 ENDBRANCH 6 24 TORSDOF 6