REMARK Name = BDB018200 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.764 -0.624 -0.877 0.00 0.00 +0.021 A ATOM 2 C LIG 1 0.319 0.215 -1.026 0.00 0.00 +0.117 A ATOM 3 N LIG 1 1.394 -0.588 -1.300 0.00 0.00 -0.267 N ATOM 4 N LIG 1 1.075 -1.897 -1.369 0.00 0.00 -0.179 NA ATOM 5 C LIG 1 -0.234 -1.915 -1.102 0.00 0.00 +0.143 A ENDROOT BRANCH 1 12 ATOM 6 C LIG 1 -5.086 -1.674 1.123 0.00 0.00 +0.152 C ATOM 7 N LIG 1 -4.260 -0.715 0.408 0.00 0.00 -0.318 N ATOM 8 C LIG 1 -4.793 0.528 0.079 0.00 0.00 +0.251 A ATOM 9 O LIG 1 -5.933 0.902 0.338 0.00 0.00 -0.268 OA ATOM 10 C LIG 1 -3.878 1.445 -0.645 0.00 0.00 +0.071 A ATOM 11 C LIG 1 -2.627 1.066 -0.935 0.00 0.00 +0.015 A ATOM 12 C LIG 1 -2.111 -0.244 -0.559 0.00 0.00 +0.001 A ATOM 13 C LIG 1 -2.956 -1.070 0.092 0.00 0.00 +0.097 A ENDBRANCH 1 12 BRANCH 3 14 ATOM 14 C LIG 1 2.762 -0.154 -1.558 0.00 0.00 +0.178 C BRANCH 14 15 ATOM 15 C LIG 1 3.449 0.317 -0.300 0.00 0.00 -0.026 A ATOM 16 C LIG 1 3.801 1.665 -0.139 0.00 0.00 +0.005 A ATOM 17 C LIG 1 4.438 2.095 1.027 0.00 0.00 +0.000 A ATOM 18 C LIG 1 4.730 1.185 2.041 0.00 0.00 +0.000 A ATOM 19 C LIG 1 4.387 -0.157 1.891 0.00 0.00 +0.000 A ATOM 20 C LIG 1 3.751 -0.590 0.728 0.00 0.00 +0.005 A ENDBRANCH 14 15 ENDBRANCH 3 14 TORSDOF 3