REMARK Name = LIG001763 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 1.178 -6.403 -1.044 0.00 0.00 +0.044 C ATOM 2 C LIG 1 0.400 -5.170 -0.689 0.00 0.00 -0.050 A ATOM 3 C LIG 1 0.821 -3.912 -1.139 0.00 0.00 +0.015 A ATOM 4 C LIG 1 0.088 -2.756 -0.833 0.00 0.00 +0.018 A ATOM 5 C LIG 1 -1.080 -2.868 -0.065 0.00 0.00 +0.128 A ATOM 6 C LIG 1 -1.526 -4.125 0.354 0.00 0.00 +0.046 A ATOM 7 C LIG 1 -0.788 -5.269 0.045 0.00 0.00 +0.007 A ENDROOT BRANCH 4 8 ATOM 8 C LIG 1 0.567 -1.467 -1.345 0.00 0.00 +0.025 C ATOM 9 C LIG 1 1.177 -0.520 -0.618 0.00 0.00 +0.047 C ATOM 10 C LIG 1 1.649 0.772 -1.128 0.00 0.00 +0.008 A ATOM 11 C LIG 1 2.213 1.437 -0.037 0.00 0.00 +0.042 A ATOM 12 C LIG 1 2.759 2.701 -0.136 0.00 0.00 +0.036 A ATOM 13 C LIG 1 2.730 3.330 -1.393 0.00 0.00 +0.057 A ATOM 14 C LIG 1 2.166 2.653 -2.503 0.00 0.00 +0.013 A ATOM 15 N LIG 1 2.132 0.654 1.109 0.00 0.00 -0.281 N ATOM 16 H LIG 1 2.463 0.905 2.028 0.00 0.00 +0.155 HD ATOM 17 C LIG 1 1.619 1.369 -2.374 0.00 0.00 +0.011 A ATOM 18 C LIG 1 1.511 -0.561 0.853 0.00 0.00 +0.249 C ATOM 19 O LIG 1 1.299 -1.442 1.662 0.00 0.00 -0.270 OA BRANCH 13 20 ATOM 20 C LIG 1 3.329 4.705 -1.570 0.00 0.00 +0.417 C ATOM 21 F LIG 1 2.671 5.456 -2.496 0.00 0.00 -0.166 F ATOM 22 F LIG 1 3.325 5.441 -0.424 0.00 0.00 -0.166 F ATOM 23 F LIG 1 4.626 4.654 -1.979 0.00 0.00 -0.166 F ENDBRANCH 13 20 ENDBRANCH 4 8 BRANCH 5 24 ATOM 24 O LIG 1 -1.800 -1.730 0.199 0.00 0.00 -0.480 OA BRANCH 24 25 ATOM 25 C LIG 1 -2.065 -1.564 1.592 0.00 0.00 +0.349 C BRANCH 25 26 ATOM 26 C LIG 1 -2.308 -0.113 1.988 0.00 0.00 +0.346 C ATOM 27 O LIG 1 -2.719 0.209 3.097 0.00 0.00 -0.247 OA BRANCH 26 28 ATOM 28 O LIG 1 -2.016 0.750 0.979 0.00 0.00 -0.457 OA BRANCH 28 29 ATOM 29 C LIG 1 -2.208 2.178 1.139 0.00 0.00 +0.105 C ATOM 30 C LIG 1 -1.278 2.744 2.218 0.00 0.00 +0.055 C ATOM 31 C LIG 1 -1.814 2.784 -0.217 0.00 0.00 +0.055 C ATOM 32 C LIG 1 -3.677 2.520 1.411 0.00 0.00 +0.055 C ENDBRANCH 28 29 ENDBRANCH 26 28 ENDBRANCH 25 26 ENDBRANCH 24 25 ENDBRANCH 5 24 TORSDOF 7