REMARK Name = LIG001499 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 0.016 -0.359 -0.060 0.00 0.00 -0.222 N ATOM 2 C LIG 1 0.732 0.674 -0.604 0.00 0.00 +0.254 C ATOM 3 O LIG 1 0.330 1.665 -1.183 0.00 0.00 -0.270 OA ATOM 4 C LIG 1 2.141 0.392 -0.341 0.00 0.00 +0.049 A ATOM 5 C LIG 1 2.203 -0.779 0.391 0.00 0.00 +0.049 A ATOM 6 C LIG 1 3.403 -1.317 0.812 0.00 0.00 +0.014 A ATOM 7 C LIG 1 4.569 -0.626 0.465 0.00 0.00 +0.001 A ATOM 8 C LIG 1 4.506 0.570 -0.281 0.00 0.00 +0.001 A ATOM 9 C LIG 1 3.277 1.095 -0.693 0.00 0.00 +0.014 A ATOM 10 C LIG 1 0.833 -1.245 0.590 0.00 0.00 +0.254 C ATOM 11 O LIG 1 0.530 -2.242 1.217 0.00 0.00 -0.270 OA ENDROOT BRANCH 1 18 ATOM 12 O LIG 1 -5.272 1.116 0.045 0.00 0.00 -0.275 OA ATOM 13 C LIG 1 -4.131 0.665 0.020 0.00 0.00 +0.219 C ATOM 14 N LIG 1 -3.235 0.948 1.021 0.00 0.00 -0.255 N ATOM 15 H LIG 1 -3.556 1.591 1.732 0.00 0.00 +0.158 HD ATOM 16 C LIG 1 -1.911 0.579 1.100 0.00 0.00 +0.240 C ATOM 17 O LIG 1 -1.203 0.991 2.017 0.00 0.00 -0.273 OA ATOM 18 C LIG 1 -1.434 -0.412 0.032 0.00 0.00 +0.171 C ATOM 19 C LIG 1 -2.157 -0.152 -1.287 0.00 0.00 +0.041 C ATOM 20 C LIG 1 -3.658 -0.273 -1.067 0.00 0.00 +0.098 C ENDBRANCH 1 18 TORSDOF 1