REMARK Name = BDB015268 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.134 0.388 0.035 0.00 0.00 +0.154 C ENDROOT BRANCH 1 2 ATOM 2 O LIG 1 0.254 1.083 1.233 0.00 0.00 -0.388 OA ATOM 3 H LIG 1 -0.576 1.173 1.745 0.00 0.00 +0.210 HD ENDBRANCH 1 2 BRANCH 1 4 ATOM 4 C LIG 1 -1.536 0.892 -0.374 0.00 0.00 +0.118 C BRANCH 4 5 ATOM 5 N LIG 1 -2.505 0.791 0.744 0.00 0.00 -0.295 NA ATOM 6 C LIG 1 -3.734 1.560 0.450 0.00 0.00 +0.120 C ATOM 7 C LIG 1 -4.854 0.752 -0.159 0.00 0.00 -0.030 A ATOM 8 C LIG 1 -5.130 -0.506 0.404 0.00 0.00 -0.042 A ATOM 9 C LIG 1 -6.210 -1.262 -0.054 0.00 0.00 +0.004 A ATOM 10 C LIG 1 -7.006 -0.769 -1.088 0.00 0.00 +0.000 A ATOM 11 C LIG 1 -6.731 0.477 -1.655 0.00 0.00 +0.000 A ATOM 12 C LIG 1 -4.214 -0.966 1.506 0.00 0.00 +0.051 C ATOM 13 C LIG 1 -5.662 1.242 -1.188 0.00 0.00 +0.005 A ATOM 14 C LIG 1 -2.767 -0.624 1.111 0.00 0.00 +0.089 C ENDBRANCH 4 5 ENDBRANCH 1 4 BRANCH 1 15 ATOM 15 C LIG 1 0.888 0.650 -1.083 0.00 0.00 +0.192 C BRANCH 15 16 ATOM 16 O LIG 1 2.067 -0.154 -0.965 0.00 0.00 -0.375 OA BRANCH 16 17 ATOM 17 C LIG 1 2.912 0.236 0.127 0.00 0.00 +0.191 C BRANCH 17 18 ATOM 18 C LIG 1 4.292 -0.415 -0.050 0.00 0.00 +0.144 C ATOM 19 O LIG 1 5.005 0.249 -1.103 0.00 0.00 -0.374 OA ATOM 20 C LIG 1 6.182 -0.458 -1.499 0.00 0.00 +0.160 C ATOM 21 C LIG 1 6.899 -1.145 -0.337 0.00 0.00 +0.028 C ATOM 22 C LIG 1 6.623 -0.429 0.976 0.00 0.00 +0.005 C ATOM 23 C LIG 1 5.120 -0.311 1.237 0.00 0.00 +0.034 C ENDBRANCH 17 18 ENDBRANCH 16 17 ENDBRANCH 15 16 ENDBRANCH 1 15 TORSDOF 7