REMARK Name = BDB016254 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -1.776 -2.213 -1.517 0.00 0.00 +0.000 C ATOM 2 C LIG 1 -2.401 -0.954 -0.921 0.00 0.00 +0.000 C ATOM 3 O LIG 1 -1.325 -0.057 -0.665 0.00 0.00 +0.000 OA ATOM 4 C LIG 1 -1.560 0.904 0.281 0.00 0.00 +0.000 A ATOM 5 C LIG 1 -2.792 1.531 0.532 0.00 0.00 +0.000 A ATOM 6 C LIG 1 -2.860 2.497 1.555 0.00 0.00 +0.000 A ATOM 7 C LIG 1 -1.736 2.856 2.299 0.00 0.00 +0.000 A ATOM 8 C LIG 1 -0.514 2.254 2.029 0.00 0.00 +0.000 A ATOM 9 N LIG 1 -4.007 1.321 -0.149 0.00 0.00 +0.000 N ATOM 10 H LIG 1 -4.809 1.852 0.172 0.00 0.00 +0.000 HD ATOM 11 C LIG 1 -4.343 0.546 -1.212 0.00 0.00 +0.000 C ATOM 12 O LIG 1 -5.509 0.585 -1.615 0.00 0.00 +0.000 OA ATOM 13 C LIG 1 -0.420 1.286 1.025 0.00 0.00 +0.000 A ATOM 14 C LIG 1 -3.325 -0.294 -1.918 0.00 0.00 +0.000 C ENDROOT BRANCH 13 15 ATOM 15 C LIG 1 0.861 0.682 0.789 0.00 0.00 +0.000 C ATOM 16 C LIG 1 1.928 0.169 0.587 0.00 0.00 +0.000 C BRANCH 16 17 ATOM 17 SI LIG 1 3.581 -0.667 0.232 0.00 0.00 +0.000 Si ATOM 18 C LIG 1 4.679 0.493 -0.751 0.00 0.00 +0.000 C ATOM 19 C LIG 1 4.429 -1.101 1.847 0.00 0.00 +0.000 C ATOM 20 C LIG 1 3.293 -2.235 -0.758 0.00 0.00 +0.000 C ENDBRANCH 16 17 ENDBRANCH 13 15 TORSDOF 2