HEADER Ideal coordinates for PDB-CCD AN2 COMPND AN2 AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 N3B AN2 A 1 -6.478 2.318 -1.130 1.00 20.00 N HETATM 2 PB AN2 A 1 -5.565 1.274 -0.176 1.00 20.00 P HETATM 3 O2B AN2 A 1 -4.927 2.093 1.055 1.00 20.00 O HETATM 4 O1B AN2 A 1 -6.434 0.196 0.346 1.00 20.00 O HETATM 5 O3A AN2 A 1 -4.384 0.631 -1.062 1.00 20.00 O HETATM 6 PA AN2 A 1 -3.556 -0.350 -0.091 1.00 20.00 P HETATM 7 O1A AN2 A 1 -3.415 0.278 1.242 1.00 20.00 O HETATM 8 O2A AN2 A 1 -4.341 -1.749 0.055 1.00 20.00 O HETATM 9 O5' AN2 A 1 -2.096 -0.617 -0.716 1.00 20.00 O HETATM 10 C5' AN2 A 1 -1.373 -1.393 0.241 1.00 20.00 C HETATM 11 C4' AN2 A 1 0.031 -1.683 -0.294 1.00 20.00 C HETATM 12 O4' AN2 A 1 0.794 -0.460 -0.391 1.00 20.00 O HETATM 13 C3' AN2 A 1 0.819 -2.561 0.704 1.00 20.00 C HETATM 14 O3' AN2 A 1 0.774 -3.933 0.307 1.00 20.00 O HETATM 15 C2' AN2 A 1 2.265 -2.019 0.621 1.00 20.00 C HETATM 16 O2' AN2 A 1 3.158 -3.041 0.174 1.00 20.00 O HETATM 17 C1' AN2 A 1 2.177 -0.876 -0.414 1.00 20.00 C HETATM 18 N9 AN2 A 1 3.050 0.234 -0.023 1.00 20.00 N HETATM 19 C8 AN2 A 1 2.687 1.328 0.704 1.00 20.00 C HETATM 20 N7 AN2 A 1 3.711 2.114 0.867 1.00 20.00 N HETATM 21 C5 AN2 A 1 4.795 1.573 0.261 1.00 20.00 C HETATM 22 C4 AN2 A 1 4.383 0.363 -0.322 1.00 20.00 C HETATM 23 N3 AN2 A 1 5.270 -0.368 -0.989 1.00 20.00 N HETATM 24 C2 AN2 A 1 6.517 0.035 -1.108 1.00 20.00 C HETATM 25 N1 AN2 A 1 6.950 1.166 -0.582 1.00 20.00 N HETATM 26 C6 AN2 A 1 6.135 1.963 0.102 1.00 20.00 C HETATM 27 N6 AN2 A 1 6.598 3.147 0.649 1.00 20.00 N HETATM 28 H3B1 AN2 A 1 -7.201 2.695 -0.537 1.00 20.00 H HETATM 29 H3B2 AN2 A 1 -5.874 3.088 -1.377 1.00 20.00 H HETATM 30 HO2B AN2 A 1 -4.369 2.784 0.672 1.00 20.00 H HETATM 31 HO2A AN2 A 1 -4.411 -2.124 -0.833 1.00 20.00 H HETATM 32 H5'1 AN2 A 1 -1.896 -2.333 0.418 1.00 20.00 H HETATM 33 H5'2 AN2 A 1 -1.297 -0.838 1.177 1.00 20.00 H HETATM 34 H4' AN2 A 1 -0.028 -2.172 -1.266 1.00 20.00 H HETATM 35 H3' AN2 A 1 0.422 -2.443 1.712 1.00 20.00 H HETATM 36 HA AN2 A 1 1.280 -4.431 0.964 1.00 20.00 H HETATM 37 H2' AN2 A 1 2.584 -1.632 1.589 1.00 20.00 H HETATM 38 HB AN2 A 1 3.123 -3.751 0.830 1.00 20.00 H HETATM 39 H1' AN2 A 1 2.448 -1.240 -1.405 1.00 20.00 H HETATM 40 H8 AN2 A 1 1.695 1.515 1.088 1.00 20.00 H HETATM 41 H2 AN2 A 1 7.213 -0.583 -1.656 1.00 20.00 H HETATM 42 H6N1 AN2 A 1 7.527 3.404 0.535 1.00 20.00 H HETATM 43 H6N2 AN2 A 1 5.993 3.723 1.142 1.00 20.00 H CONECT 1 2 28 29 CONECT 2 3 4 4 5 CONECT 3 30 CONECT 5 6 CONECT 6 7 7 8 9 CONECT 8 31 CONECT 9 10 CONECT 10 11 32 33 CONECT 11 12 13 34 CONECT 12 17 CONECT 13 14 15 35 CONECT 14 36 CONECT 15 16 17 37 CONECT 16 38 CONECT 17 18 39 CONECT 18 19 22 CONECT 19 20 20 40 CONECT 20 21 CONECT 21 22 22 26 CONECT 22 23 CONECT 23 24 24 CONECT 24 25 41 CONECT 25 26 26 CONECT 26 27 CONECT 27 42 43 END