@MOLECULE porphine 38 42 0 0 0 SMALL GASTEIGER @ATOM 1 C 0.3486 4.3147 0.0019 C.2 1 UNL111111111 -0.2258 2 C 1.6688 4.0151 0.0202 C.2 1 UNL111111111 -0.1511 3 C 1.7829 2.5346 0.0258 C.2 1 UNL111111111 0.0736 4 C -0.3838 3.0160 -0.0023 C.2 1 UNL111111111 0.2425 5 N 0.4651 1.9912 0.0123 N.2 1 UNL111111111 -0.4723 6 C -1.8109 2.9399 -0.0049 C.2 1 UNL111111111 -0.3302 7 C -2.5316 1.7917 -0.0362 C.ar 1 UNL111111111 0.2483 8 N -2.0302 0.4891 -0.1249 N.ar 1 UNL111111111 -0.4251 9 C -3.0718 -0.4398 -0.0366 C.ar 1 UNL111111111 0.2484 10 C -4.0126 1.6638 0.0306 C.ar 1 UNL111111111 -0.1636 11 C -4.3304 0.3509 0.0305 C.ar 1 UNL111111111 -0.1637 12 C -2.9547 -1.7904 -0.0057 C.2 1 UNL111111111 -0.3303 13 C -1.7193 -2.5087 -0.0032 C.2 1 UNL111111111 0.2426 14 N -0.4965 -1.9836 0.0106 N.2 1 UNL111111111 -0.4724 15 C -0.3480 -4.3337 0.0214 C.2 1 UNL111111111 -0.1510 16 C -1.6595 -3.9984 0.0027 C.2 1 UNL111111111 -0.2259 17 C 2.5530 -1.7761 0.0209 C.ar 1 UNL111111111 0.0306 18 N 2.0418 -0.4922 0.0928 N.ar 1 UNL111111111 -0.2052 19 C 3.0832 0.4160 0.0212 C.ar 1 UNL111111111 0.0307 20 C 4.2960 -0.3186 -0.0851 C.ar 1 UNL111111111 -0.2001 21 C 3.9676 -1.6766 -0.0851 C.ar 1 UNL111111111 -0.2001 22 C 2.9399 1.8355 0.0329 C.2 1 UNL111111111 -0.0931 23 C 1.7772 -2.9734 0.0331 C.2 1 UNL111111111 -0.0932 24 C 0.4287 -3.0679 0.0254 C.2 1 UNL111111111 0.0738 25 H -0.1366 5.2657 -0.0093 H 1 UNL111111111 0.1611 26 H 2.5145 4.6701 0.0285 H 1 UNL111111111 0.1590 27 H -2.3385 3.8948 0.0341 H 1 UNL111111111 0.1778 28 H -1.0472 0.2511 -0.1746 H 1 UNL111111111 0.3721 29 H -4.6583 2.5188 0.0743 H 1 UNL111111111 0.1699 30 H -5.2956 -0.1140 0.0742 H 1 UNL111111111 0.1700 31 H -3.8597 -2.3995 0.0331 H 1 UNL111111111 0.1778 32 H 0.1056 -5.3024 0.0309 H 1 UNL111111111 0.1590 33 H -2.5250 -4.6234 -0.0076 H 1 UNL111111111 0.1611 34 H 1.0651 -0.2560 0.1936 H 1 UNL111111111 0.3529 35 H 5.2735 0.1058 -0.1556 H 1 UNL111111111 0.1573 36 H 4.6431 -2.5007 -0.1560 H 1 UNL111111111 0.1573 37 H 3.8888 2.3909 0.0361 H 1 UNL111111111 0.1686 38 H 2.3685 -3.9003 0.0376 H 1 UNL111111111 0.1686 @BOND 1 1 2 2 2 2 3 1 3 1 4 1 4 4 5 2 5 5 3 1 6 4 6 1 7 6 7 2 8 7 8 ar 9 8 9 ar 10 7 10 ar 11 10 11 ar 12 11 9 ar 13 9 12 2 14 12 13 1 15 13 14 2 16 15 16 2 17 16 13 1 18 17 18 ar 19 18 19 ar 20 19 20 ar 21 20 21 ar 22 21 17 ar 23 3 22 2 24 22 19 1 25 14 24 1 26 24 15 1 27 24 23 2 28 23 17 1 29 1 25 1 30 2 26 1 31 6 27 1 32 8 28 1 33 10 29 1 34 11 30 1 35 12 31 1 36 15 32 1 37 16 33 1 38 18 34 1 39 20 35 1 40 21 36 1 41 22 37 1 42 23 38 1