@MOLECULE (1r,9s,10r,16r)-16-methyl-6,14-diazatetracyclo[7.5.3.0~1,10~.0~2,7~]heptadeca-2,4,6-triene 40 43 0 0 0 SMALL GASTEIGER @ATOM 1 N -1.2087 1.8728 0.4443 N.3 1 UNL111111111 -0.8165 2 N 2.8765 -0.1041 -1.0493 N.ar 1 UNL111111111 -0.5878 3 C -0.6234 0.5136 0.2578 C.3 1 UNL111111111 0.9152 4 C -1.2459 -0.1813 -0.9848 C.3 1 UNL111111111 -0.5101 5 C -0.5937 -1.5599 -1.1416 C.3 1 UNL111111111 0.2583 6 C -0.8502 -0.3049 1.5484 C.3 1 UNL111111111 -1.0678 7 C -0.7836 -2.4338 0.1088 C.3 1 UNL111111111 -0.8988 8 C -0.4468 -1.7862 1.4653 C.3 1 UNL111111111 0.5039 9 C -2.7737 -0.2486 -0.8722 C.3 1 UNL111111111 -0.3111 10 C 0.8850 -1.3669 -1.5213 C.3 1 UNL111111111 -1.0032 11 C 0.8630 0.6713 0.0257 C.ar 1 UNL111111111 -0.5611 12 C -3.3396 1.1676 -0.7168 C.3 1 UNL111111111 -0.5130 13 C 1.5498 -0.2186 -0.8208 C.ar 1 UNL111111111 0.7263 14 C -2.6848 1.8686 0.4893 C.3 1 UNL111111111 -0.1433 15 C 1.0186 -2.0096 1.8559 C.3 1 UNL111111111 -1.0874 16 C 1.5907 1.6684 0.6740 C.ar 1 UNL111111111 0.0961 17 C 2.9589 1.7834 0.4428 C.ar 1 UNL111111111 -0.5155 18 C 3.5616 0.8774 -0.4371 C.ar 1 UNL111111111 0.1725 19 H -0.9962 0.4308 -1.8879 H 1 UNL111111111 0.2349 20 H -1.0900 -2.0940 -1.9929 H 1 UNL111111111 0.1558 21 H -1.9210 -0.2451 1.8265 H 1 UNL111111111 0.3314 22 H -0.3072 0.1909 2.3774 H 1 UNL111111111 0.3198 23 H -1.8424 -2.7629 0.1366 H 1 UNL111111111 0.2381 24 H -0.1898 -3.3618 -0.0058 H 1 UNL111111111 0.2980 25 H -1.0626 -2.3241 2.2381 H 1 UNL111111111 0.0988 26 H -3.0724 -0.8764 -0.0123 H 1 UNL111111111 0.2121 27 H -3.2002 -0.7367 -1.7670 H 1 UNL111111111 0.1679 28 H 0.9751 -1.2132 -2.6199 H 1 UNL111111111 0.3117 29 H 1.4570 -2.3002 -1.3207 H 1 UNL111111111 0.3386 30 H -0.8816 2.4941 -0.2979 H 1 UNL111111111 0.3753 31 H -3.1633 1.7511 -1.6385 H 1 UNL111111111 0.2252 32 H -4.4349 1.1317 -0.5847 H 1 UNL111111111 0.1877 33 H -3.0234 2.9252 0.5571 H 1 UNL111111111 0.1756 34 H -3.0033 1.3791 1.4357 H 1 UNL111111111 0.1709 35 H 1.7129 -1.5754 1.1310 H 1 UNL111111111 0.3565 36 H 1.2444 -1.5552 2.8268 H 1 UNL111111111 0.2896 37 H 1.2523 -3.0771 1.9268 H 1 UNL111111111 0.2683 38 H 1.0845 2.3498 1.3636 H 1 UNL111111111 0.1702 39 H 3.5441 2.5536 0.9332 H 1 UNL111111111 0.2394 40 H 4.6317 0.9202 -0.6676 H 1 UNL111111111 0.1775 @BOND 1 1 3 1 2 1 14 1 3 1 30 1 4 2 13 ar 5 2 18 ar 6 3 4 1 7 3 6 1 8 3 11 1 9 4 5 1 10 4 9 1 11 4 19 1 12 5 7 1 13 5 10 1 14 5 20 1 15 6 8 1 16 6 21 1 17 6 22 1 18 7 8 1 19 7 23 1 20 7 24 1 21 8 15 1 22 8 25 1 23 9 12 1 24 9 26 1 25 9 27 1 26 10 13 1 27 10 28 1 28 10 29 1 29 11 13 ar 30 11 16 ar 31 12 14 1 32 12 31 1 33 12 32 1 34 14 33 1 35 14 34 1 36 15 35 1 37 15 36 1 38 15 37 1 39 16 17 ar 40 16 38 1 41 17 18 ar 42 17 39 1 43 18 40 1