REMARK Name = BDB060396 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 -0.668 0.120 -0.076 0.00 0.00 -0.214 N ATOM 2 C LIG 1 0.276 1.054 0.365 0.00 0.00 +0.322 C ATOM 3 O LIG 1 0.112 2.259 0.467 0.00 0.00 -0.251 OA ATOM 4 N LIG 1 1.425 0.380 0.628 0.00 0.00 -0.238 N ATOM 5 H LIG 1 2.277 0.818 0.933 0.00 0.00 +0.159 HD ATOM 6 C LIG 1 1.316 -0.922 0.249 0.00 0.00 +0.239 C ATOM 7 O LIG 1 2.223 -1.740 0.300 0.00 0.00 -0.274 OA ATOM 8 C LIG 1 -0.089 -1.187 -0.268 0.00 0.00 +0.224 C ENDROOT BRANCH 1 9 ATOM 9 N LIG 1 -1.891 0.492 -0.651 0.00 0.00 -0.250 NA ATOM 10 H LIG 1 -1.758 1.415 -1.083 0.00 0.00 +0.141 HD ATOM 11 H LIG 1 -2.544 0.680 0.116 0.00 0.00 +0.141 HD ENDBRANCH 1 9 TORSDOF 1