REMARK Name = LIG001766 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 -3.397 0.324 0.447 0.00 0.00 -0.282 N ATOM 2 C LIG 1 -3.112 -0.171 -0.818 0.00 0.00 +0.248 C ATOM 3 O LIG 1 -3.744 -0.026 -1.845 0.00 0.00 -0.270 OA ATOM 4 C LIG 1 -1.875 -0.952 -0.699 0.00 0.00 +0.042 A ATOM 5 C LIG 1 -1.506 -0.977 0.643 0.00 0.00 -0.018 A ATOM 6 C LIG 1 -0.366 -1.655 1.043 0.00 0.00 +0.011 A ATOM 7 C LIG 1 0.401 -2.315 0.065 0.00 0.00 -0.030 A ATOM 8 C LIG 1 0.007 -2.265 -1.295 0.00 0.00 +0.006 A ATOM 9 C LIG 1 -1.146 -1.583 -1.687 0.00 0.00 +0.014 A ATOM 10 C LIG 1 -2.501 -0.223 1.457 0.00 0.00 +0.144 C ENDROOT BRANCH 1 17 ATOM 11 O LIG 1 -8.637 2.026 0.513 0.00 0.00 -0.275 OA ATOM 12 C LIG 1 -7.449 1.713 0.521 0.00 0.00 +0.219 C ATOM 13 N LIG 1 -7.062 0.415 0.739 0.00 0.00 -0.255 N ATOM 14 H LIG 1 -7.809 -0.255 0.860 0.00 0.00 +0.158 HD ATOM 15 C LIG 1 -5.788 -0.063 0.943 0.00 0.00 +0.240 C ATOM 16 O LIG 1 -5.613 -1.224 1.312 0.00 0.00 -0.273 OA ATOM 17 C LIG 1 -4.654 0.966 0.815 0.00 0.00 +0.163 C ATOM 18 C LIG 1 -5.062 2.103 -0.121 0.00 0.00 +0.041 C ATOM 19 C LIG 1 -6.347 2.738 0.388 0.00 0.00 +0.098 C ENDBRANCH 1 17 BRANCH 7 20 ATOM 20 C LIG 1 1.665 -3.044 0.451 0.00 0.00 +0.140 C BRANCH 20 21 ATOM 21 N LIG 1 2.808 -2.178 0.348 0.00 0.00 -0.306 N ATOM 22 H LIG 1 2.929 -1.413 1.005 0.00 0.00 +0.149 HD ATOM 23 C LIG 1 3.606 -2.131 -0.768 0.00 0.00 +0.264 C ATOM 24 O LIG 1 3.513 -2.899 -1.720 0.00 0.00 -0.268 OA BRANCH 23 25 ATOM 25 C LIG 1 4.587 -1.048 -0.705 0.00 0.00 +0.144 A ATOM 26 N LIG 1 4.671 -0.166 0.368 0.00 0.00 -0.223 NA ATOM 27 C LIG 1 5.654 0.656 0.064 0.00 0.00 +0.138 A ATOM 28 N LIG 1 6.216 0.346 -1.171 0.00 0.00 -0.306 N ATOM 29 C LIG 1 7.272 1.056 -1.737 0.00 0.00 +0.093 A ATOM 30 C LIG 1 7.790 2.100 -1.069 0.00 0.00 +0.018 A ATOM 31 C LIG 1 7.230 2.456 0.227 0.00 0.00 +0.005 A ATOM 32 C LIG 1 6.207 1.764 0.767 0.00 0.00 +0.047 A ATOM 33 C LIG 1 5.536 -0.738 -1.658 0.00 0.00 +0.125 A ENDBRANCH 23 25 ENDBRANCH 20 21 ENDBRANCH 7 20 TORSDOF 4