REMARK Name = LIG001434 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.146 -1.707 -0.769 0.00 0.00 -0.030 A ATOM 2 C LIG 1 -1.242 -1.492 -1.626 0.00 0.00 +0.011 A ATOM 3 C LIG 1 -2.397 -0.941 -1.097 0.00 0.00 -0.018 A ATOM 4 C LIG 1 -3.681 -0.592 -1.768 0.00 0.00 +0.144 C ATOM 5 N LIG 1 -4.505 -0.120 -0.664 0.00 0.00 -0.282 N ATOM 6 C LIG 1 -3.786 -0.030 0.516 0.00 0.00 +0.248 C ATOM 7 O LIG 1 -4.130 0.458 1.573 0.00 0.00 -0.270 OA ATOM 8 C LIG 1 -2.462 -0.605 0.253 0.00 0.00 +0.042 A ATOM 9 C LIG 1 -1.408 -0.797 1.124 0.00 0.00 +0.014 A ATOM 10 C LIG 1 -0.241 -1.358 0.601 0.00 0.00 +0.006 A ENDROOT BRANCH 5 11 ATOM 11 C LIG 1 -5.812 0.481 -0.905 0.00 0.00 +0.163 C ATOM 12 C LIG 1 -5.699 2.006 -0.912 0.00 0.00 +0.240 C ATOM 13 O LIG 1 -4.985 2.606 -1.717 0.00 0.00 -0.273 OA ATOM 14 N LIG 1 -6.394 2.691 0.050 0.00 0.00 -0.255 N ATOM 15 H LIG 1 -6.299 3.696 0.031 0.00 0.00 +0.158 HD ATOM 16 C LIG 1 -7.090 2.191 1.119 0.00 0.00 +0.219 C ATOM 17 O LIG 1 -7.623 2.951 1.924 0.00 0.00 -0.275 OA ATOM 18 C LIG 1 -7.146 0.693 1.273 0.00 0.00 +0.098 C ATOM 19 C LIG 1 -6.955 -0.045 -0.039 0.00 0.00 +0.041 C ENDBRANCH 5 11 BRANCH 1 20 ATOM 20 C LIG 1 1.146 -2.287 -1.305 0.00 0.00 +0.144 C BRANCH 20 24 ATOM 21 N LIG 1 3.979 -0.148 -0.401 0.00 0.00 -0.269 N ATOM 22 H LIG 1 3.578 0.670 -0.829 0.00 0.00 +0.156 HD ATOM 23 C LIG 1 3.183 -1.273 -0.408 0.00 0.00 +0.306 C ATOM 24 N LIG 1 2.200 -1.279 -1.397 0.00 0.00 -0.284 N ATOM 25 C LIG 1 2.058 -0.277 -2.445 0.00 0.00 +0.134 C ATOM 26 O LIG 1 3.293 -2.200 0.390 0.00 0.00 -0.252 OA BRANCH 21 32 ATOM 27 C LIG 1 8.711 1.030 2.627 0.00 0.00 +0.045 C ATOM 28 C LIG 1 7.475 0.680 1.847 0.00 0.00 -0.032 A ATOM 29 C LIG 1 6.974 -0.629 1.796 0.00 0.00 +0.046 A ATOM 30 CL LIG 1 7.764 -1.924 2.626 0.00 0.00 -0.083 Cl ATOM 31 C LIG 1 5.819 -0.929 1.063 0.00 0.00 +0.043 A ATOM 32 C LIG 1 5.139 0.074 0.372 0.00 0.00 +0.036 A ATOM 33 C LIG 1 5.643 1.379 0.409 0.00 0.00 +0.024 A ATOM 34 C LIG 1 6.795 1.681 1.142 0.00 0.00 +0.006 A ENDBRANCH 21 32 ENDBRANCH 20 24 ENDBRANCH 1 20 TORSDOF 4