REMARK Name = BDB003660 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 6.178 0.331 0.230 0.00 0.00 +0.048 C ATOM 2 C LIG 1 4.872 -0.366 0.300 0.00 0.00 -0.001 A ATOM 3 C LIG 1 3.581 0.195 0.107 0.00 0.00 +0.074 A ATOM 4 C LIG 1 3.089 1.515 -0.194 0.00 0.00 +0.237 C ATOM 5 C LIG 1 1.569 1.663 -0.435 0.00 0.00 +0.234 C ATOM 6 C LIG 1 0.648 0.502 -0.100 0.00 0.00 +0.040 A ATOM 7 C LIG 1 -0.771 0.628 -0.121 0.00 0.00 -0.032 A ATOM 8 C LIG 1 -1.420 1.974 -0.383 0.00 0.00 +0.036 C ATOM 9 C LIG 1 -2.899 2.049 -0.032 0.00 0.00 +0.005 C ATOM 10 C LIG 1 -3.623 0.843 -0.598 0.00 0.00 +0.011 C ATOM 11 C LIG 1 -3.114 -0.477 0.027 0.00 0.00 -0.010 C ATOM 12 C LIG 1 -3.673 -0.627 1.459 0.00 0.00 +0.016 C ATOM 13 C LIG 1 -3.686 -1.622 -0.842 0.00 0.00 +0.016 C ATOM 14 C LIG 1 -1.576 -0.525 0.086 0.00 0.00 -0.038 A ATOM 15 C LIG 1 -0.944 -1.748 0.390 0.00 0.00 +0.005 A ATOM 16 C LIG 1 0.441 -1.858 0.458 0.00 0.00 +0.012 A ATOM 17 C LIG 1 1.240 -0.746 0.209 0.00 0.00 +0.029 A ATOM 18 O LIG 1 1.161 2.704 -0.931 0.00 0.00 -0.283 OA ATOM 19 O LIG 1 3.825 2.490 -0.263 0.00 0.00 -0.283 OA ATOM 20 C LIG 1 2.681 -0.822 0.275 0.00 0.00 +0.147 A ATOM 21 O LIG 1 3.310 -1.988 0.555 0.00 0.00 -0.462 OA ATOM 22 C LIG 1 4.643 -1.705 0.567 0.00 0.00 +0.199 A ENDROOT TORSDOF 0