REMARK Name = LIG001143 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 0.857 -0.231 -0.124 0.00 0.00 -0.251 N ATOM 2 C LIG 1 1.128 0.635 -1.185 0.00 0.00 +0.313 C ATOM 3 O LIG 1 0.326 1.044 -2.021 0.00 0.00 -0.252 OA ATOM 4 N LIG 1 2.448 1.011 -1.302 0.00 0.00 -0.240 N ATOM 5 H LIG 1 2.655 1.617 -2.082 0.00 0.00 +0.159 HD ATOM 6 C LIG 1 3.443 0.835 -0.381 0.00 0.00 +0.222 C ATOM 7 O LIG 1 4.553 1.340 -0.529 0.00 0.00 -0.275 OA ATOM 8 C LIG 1 3.071 0.058 0.846 0.00 0.00 +0.115 C ATOM 9 C LIG 1 1.974 -0.925 0.496 0.00 0.00 +0.124 C ENDROOT BRANCH 1 11 ATOM 10 C LIG 1 -1.544 0.265 0.243 0.00 0.00 +0.141 A ATOM 11 C LIG 1 -0.479 -0.655 0.157 0.00 0.00 +0.079 A ATOM 12 C LIG 1 -0.751 -2.016 0.377 0.00 0.00 +0.027 A ATOM 13 C LIG 1 -2.051 -2.454 0.645 0.00 0.00 +0.002 A ATOM 14 C LIG 1 -3.095 -1.537 0.718 0.00 0.00 +0.004 A ATOM 15 C LIG 1 -2.841 -0.179 0.530 0.00 0.00 +0.047 A BRANCH 10 17 ATOM 16 C LIG 1 -2.126 2.343 -0.658 0.00 0.00 +0.277 C ATOM 17 O LIG 1 -1.259 1.610 0.205 0.00 0.00 -0.493 OA ENDBRANCH 10 17 ENDBRANCH 1 11 TORSDOF 2