COMPND HMDB0014384 HETATM 1 CL1 UNL 1 6.558 -2.437 1.253 1.00 0.00 CL HETATM 2 C1 UNL 1 5.321 -1.360 0.613 1.00 0.00 C HETATM 3 C2 UNL 1 4.015 -1.430 1.041 1.00 0.00 C HETATM 4 C3 UNL 1 3.061 -0.561 0.512 1.00 0.00 C HETATM 5 C4 UNL 1 3.373 0.377 -0.432 1.00 0.00 C HETATM 6 C5 UNL 1 2.380 1.311 -1.002 1.00 0.00 C HETATM 7 O1 UNL 1 1.077 1.158 -0.513 1.00 0.00 O HETATM 8 N1 UNL 1 0.378 0.028 -0.648 1.00 0.00 N HETATM 9 C6 UNL 1 -0.935 -0.125 -0.352 1.00 0.00 C HETATM 10 C7 UNL 1 -1.442 -1.470 -0.586 1.00 0.00 C HETATM 11 N2 UNL 1 -2.393 -2.176 0.115 1.00 0.00 N HETATM 12 C8 UNL 1 -3.728 -2.259 -0.172 1.00 0.00 C HETATM 13 C9 UNL 1 -4.329 -3.084 0.720 1.00 0.00 C HETATM 14 N3 UNL 1 -3.376 -3.509 1.551 1.00 0.00 N HETATM 15 C10 UNL 1 -2.214 -2.965 1.189 1.00 0.00 C HETATM 16 C11 UNL 1 -1.623 1.103 -0.109 1.00 0.00 C HETATM 17 C12 UNL 1 -1.225 2.235 -0.879 1.00 0.00 C HETATM 18 C13 UNL 1 -1.908 3.411 -0.924 1.00 0.00 C HETATM 19 C14 UNL 1 -3.061 3.573 -0.203 1.00 0.00 C HETATM 20 CL2 UNL 1 -3.916 5.087 -0.283 1.00 0.00 CL HETATM 21 C15 UNL 1 -3.496 2.520 0.559 1.00 0.00 C HETATM 22 C16 UNL 1 -2.774 1.326 0.590 1.00 0.00 C HETATM 23 CL3 UNL 1 -3.314 0.132 1.769 1.00 0.00 CL HETATM 24 C17 UNL 1 4.686 0.435 -0.850 1.00 0.00 C HETATM 25 CL4 UNL 1 5.123 1.621 -2.055 1.00 0.00 CL HETATM 26 C18 UNL 1 5.651 -0.419 -0.338 1.00 0.00 C HETATM 27 H1 UNL 1 3.734 -2.154 1.780 1.00 0.00 H HETATM 28 H2 UNL 1 2.038 -0.637 0.870 1.00 0.00 H HETATM 29 H3 UNL 1 2.759 2.351 -0.874 1.00 0.00 H HETATM 30 H4 UNL 1 2.375 1.143 -2.119 1.00 0.00 H HETATM 31 H5 UNL 1 -1.742 -1.417 -1.731 1.00 0.00 H HETATM 32 H6 UNL 1 -0.545 -2.197 -0.737 1.00 0.00 H HETATM 33 H7 UNL 1 -4.201 -1.727 -0.999 1.00 0.00 H HETATM 34 H8 UNL 1 -5.396 -3.319 0.710 1.00 0.00 H HETATM 35 H9 UNL 1 -1.282 -3.155 1.709 1.00 0.00 H HETATM 36 H10 UNL 1 -0.355 2.123 -1.488 1.00 0.00 H HETATM 37 H11 UNL 1 -1.554 4.231 -1.525 1.00 0.00 H HETATM 38 H12 UNL 1 -4.407 2.625 1.137 1.00 0.00 H HETATM 39 H13 UNL 1 6.687 -0.391 -0.652 1.00 0.00 H CONECT 1 2 CONECT 2 3 3 26 CONECT 3 4 27 CONECT 4 5 5 28 CONECT 5 6 24 CONECT 6 7 29 30 CONECT 7 8 CONECT 8 9 9 CONECT 9 10 16 CONECT 10 11 31 32 CONECT 11 12 15 CONECT 12 13 13 33 CONECT 13 14 34 CONECT 14 15 15 CONECT 15 35 CONECT 16 17 17 22 CONECT 17 18 36 CONECT 18 19 19 37 CONECT 19 20 21 CONECT 21 22 22 38 CONECT 22 23 CONECT 24 25 26 26 CONECT 26 39 END