HEADER Ideal coordinates for PDB-CCD L6P COMPND L6P AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 CAA L6P A 1 -3.414 0.390 -0.001 1.00 20.00 C HETATM 2 CAB L6P A 1 -3.932 -0.906 0.041 1.00 20.00 C HETATM 3 CAC L6P A 1 -3.185 -1.932 0.623 1.00 20.00 C HETATM 4 CAD L6P A 1 -1.940 -1.659 1.153 1.00 20.00 C HETATM 5 CAE L6P A 1 -1.433 -0.373 1.109 1.00 20.00 C HETATM 6 CAF L6P A 1 -2.168 0.648 0.533 1.00 20.00 C HETATM 7 CAG L6P A 1 -5.224 -1.182 -0.511 1.00 20.00 C HETATM 8 CAI L6P A 1 -4.210 1.502 -0.632 1.00 20.00 C HETATM 9 CAJ L6P A 1 -3.511 2.849 -0.828 1.00 20.00 C HETATM 10 CAK L6P A 1 -4.584 2.694 0.252 1.00 20.00 C HETATM 11 CAL L6P A 1 -0.073 -0.083 1.690 1.00 20.00 C HETATM 12 CAM L6P A 1 0.978 -0.265 0.626 1.00 20.00 C HETATM 13 CAO L6P A 1 3.299 -0.236 -0.116 1.00 20.00 C HETATM 14 CAQ L6P A 1 4.442 2.461 -0.171 1.00 20.00 C HETATM 15 CAR L6P A 1 4.717 1.500 0.987 1.00 20.00 C HETATM 16 CAS L6P A 1 4.679 0.059 0.474 1.00 20.00 C HETATM 17 CAT L6P A 1 3.023 0.725 -1.275 1.00 20.00 C HETATM 18 CAU L6P A 1 3.062 2.166 -0.762 1.00 20.00 C HETATM 19 CAV L6P A 1 3.261 -1.655 -0.621 1.00 20.00 C HETATM 20 NAH L6P A 1 -6.249 -1.401 -0.949 1.00 20.00 N HETATM 21 NAN L6P A 1 2.277 -0.058 0.919 1.00 20.00 N HETATM 22 OAP L6P A 1 0.655 -0.598 -0.495 1.00 20.00 O HETATM 23 OAW L6P A 1 4.285 -2.209 -0.944 1.00 20.00 O HETATM 24 OAX L6P A 1 2.089 -2.304 -0.712 1.00 20.00 O HETATM 25 H1 L6P A 1 -3.580 -2.937 0.658 1.00 20.00 H HETATM 26 H2 L6P A 1 -1.361 -2.452 1.604 1.00 20.00 H HETATM 27 H3 L6P A 1 -1.766 1.650 0.502 1.00 20.00 H HETATM 28 H4 L6P A 1 -4.930 1.193 -1.391 1.00 20.00 H HETATM 29 H5 L6P A 1 -2.475 2.930 -0.500 1.00 20.00 H HETATM 30 H6 L6P A 1 -3.770 3.426 -1.716 1.00 20.00 H HETATM 31 H7 L6P A 1 -5.549 3.169 0.074 1.00 20.00 H HETATM 32 H8 L6P A 1 -4.253 2.673 1.290 1.00 20.00 H HETATM 33 H9 L6P A 1 -0.046 0.944 2.055 1.00 20.00 H HETATM 34 H10 L6P A 1 0.123 -0.767 2.515 1.00 20.00 H HETATM 35 H11 L6P A 1 4.469 3.488 0.194 1.00 20.00 H HETATM 36 H12 L6P A 1 5.202 2.329 -0.941 1.00 20.00 H HETATM 37 H13 L6P A 1 5.701 1.710 1.408 1.00 20.00 H HETATM 38 H14 L6P A 1 3.957 1.632 1.757 1.00 20.00 H HETATM 39 H15 L6P A 1 4.875 -0.626 1.299 1.00 20.00 H HETATM 40 H16 L6P A 1 5.439 -0.073 -0.296 1.00 20.00 H HETATM 41 H17 L6P A 1 3.784 0.593 -2.044 1.00 20.00 H HETATM 42 H18 L6P A 1 2.040 0.515 -1.695 1.00 20.00 H HETATM 43 H19 L6P A 1 2.302 2.298 0.008 1.00 20.00 H HETATM 44 H20 L6P A 1 2.866 2.851 -1.587 1.00 20.00 H HETATM 45 H21 L6P A 1 2.535 0.208 1.815 1.00 20.00 H HETATM 46 H22 L6P A 1 2.116 -3.213 -1.042 1.00 20.00 H CONECT 1 8 6 2 2 CONECT 2 7 3 CONECT 3 4 4 25 CONECT 4 5 26 CONECT 5 6 6 11 CONECT 6 27 CONECT 7 20 20 20 CONECT 8 9 10 28 CONECT 9 10 29 30 CONECT 10 31 32 CONECT 11 12 33 34 CONECT 12 21 22 22 CONECT 13 19 21 17 16 CONECT 14 18 15 35 36 CONECT 15 16 37 38 CONECT 16 39 40 CONECT 17 18 41 42 CONECT 18 43 44 CONECT 19 23 23 24 CONECT 21 45 CONECT 24 46 END