REMARK Name = BDB064711 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 0.955 -0.209 -1.762 0.00 0.00 +0.165 C ENDROOT BRANCH 1 2 ATOM 2 N LIG 1 2.237 -0.523 -1.178 0.00 0.00 -0.312 N ATOM 3 C LIG 1 2.966 0.294 -0.360 0.00 0.00 +0.165 A ATOM 4 C LIG 1 4.102 -0.437 -0.050 0.00 0.00 +0.147 A ATOM 5 C LIG 1 5.034 0.181 0.799 0.00 0.00 +0.147 A ATOM 6 N LIG 1 4.778 1.436 1.235 0.00 0.00 -0.219 NA ATOM 7 C LIG 1 3.623 2.025 0.853 0.00 0.00 +0.225 A ATOM 8 N LIG 1 4.076 -1.668 -0.676 0.00 0.00 -0.231 NA ATOM 9 N LIG 1 2.650 1.529 0.060 0.00 0.00 -0.216 NA ATOM 10 C LIG 1 2.942 -1.683 -1.345 0.00 0.00 +0.201 A BRANCH 5 11 ATOM 11 N LIG 1 6.217 -0.426 1.202 0.00 0.00 -0.341 N ATOM 12 H LIG 1 6.509 -1.183 0.594 0.00 0.00 +0.144 HD ATOM 13 H LIG 1 6.915 0.249 1.483 0.00 0.00 +0.144 HD ENDBRANCH 5 11 ENDBRANCH 1 2 BRANCH 1 14 ATOM 14 C LIG 1 -0.176 -0.236 -0.738 0.00 0.00 +0.250 C BRANCH 14 15 ATOM 15 O LIG 1 -1.410 -0.059 -1.439 0.00 0.00 -0.490 OA BRANCH 15 19 ATOM 16 C LIG 1 -5.058 0.062 0.588 0.00 0.00 +0.069 A ATOM 17 C LIG 1 -4.979 0.197 -0.803 0.00 0.00 +0.073 A ATOM 18 C LIG 1 -3.726 0.149 -1.434 0.00 0.00 +0.065 A ATOM 19 C LIG 1 -2.555 -0.032 -0.693 0.00 0.00 +0.122 A ATOM 20 C LIG 1 -2.637 -0.167 0.692 0.00 0.00 +0.047 A ATOM 21 C LIG 1 -3.882 -0.120 1.329 0.00 0.00 +0.024 A BRANCH 16 23 ATOM 22 N LIG 1 -7.316 0.133 1.863 0.00 0.00 -0.191 NA ATOM 23 C LIG 1 -6.313 0.103 1.282 0.00 0.00 +0.100 C ENDBRANCH 16 23 BRANCH 17 24 ATOM 24 C LIG 1 -6.149 0.385 -1.611 0.00 0.00 +0.101 C ATOM 25 N LIG 1 -7.083 0.537 -2.281 0.00 0.00 -0.191 NA ENDBRANCH 17 24 ENDBRANCH 15 19 ENDBRANCH 14 15 ENDBRANCH 1 14 TORSDOF 7