REMARK Name = LIG001532 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -3.018 -1.082 -0.393 0.00 0.00 +0.031 A ATOM 2 C LIG 1 -1.867 -0.514 0.127 0.00 0.00 +0.003 A ATOM 3 C LIG 1 -0.449 -0.631 -0.328 0.00 0.00 +0.146 C ATOM 4 N LIG 1 0.277 0.158 0.658 0.00 0.00 -0.282 N ATOM 5 C LIG 1 -0.575 0.794 1.545 0.00 0.00 +0.248 C ATOM 6 O LIG 1 -0.291 1.591 2.418 0.00 0.00 -0.270 OA ATOM 7 C LIG 1 -1.930 0.325 1.243 0.00 0.00 +0.045 A ATOM 8 C LIG 1 -3.103 0.609 1.911 0.00 0.00 +0.033 A ATOM 9 C LIG 1 -4.252 -0.010 1.435 0.00 0.00 +0.043 A ATOM 10 CL LIG 1 -5.753 0.254 2.238 0.00 0.00 -0.083 Cl ATOM 11 C LIG 1 -4.210 -0.862 0.314 0.00 0.00 +0.043 A ENDROOT BRANCH 4 12 ATOM 12 C LIG 1 1.671 0.557 0.503 0.00 0.00 +0.163 C ATOM 13 C LIG 1 1.867 1.548 -0.656 0.00 0.00 +0.240 C ATOM 14 O LIG 1 0.952 2.107 -1.257 0.00 0.00 -0.273 OA ATOM 15 N LIG 1 3.176 1.778 -1.015 0.00 0.00 -0.255 N ATOM 16 H LIG 1 3.294 2.417 -1.791 0.00 0.00 +0.158 HD ATOM 17 C LIG 1 4.214 0.897 -0.844 0.00 0.00 +0.219 C ATOM 18 O LIG 1 5.230 0.976 -1.526 0.00 0.00 -0.275 OA ATOM 19 C LIG 1 4.040 -0.150 0.232 0.00 0.00 +0.098 C ATOM 20 C LIG 1 2.600 -0.636 0.296 0.00 0.00 +0.041 C ENDBRANCH 4 12 BRANCH 1 21 ATOM 21 N LIG 1 -2.977 -2.013 -1.432 0.00 0.00 -0.358 N ATOM 22 H LIG 1 -2.232 -1.870 -2.107 0.00 0.00 +0.142 HD ATOM 23 H LIG 1 -3.872 -2.159 -1.894 0.00 0.00 +0.142 HD ENDBRANCH 1 21 TORSDOF 2