@MOLECULE FDBD00286 58 60 0 0 0 SMALL GASTEIGER @ATOM 1 N -4.9861 2.6950 -0.0231 N.pl3 1 UNK -0.3360 2 N1 4.9744 2.7144 0.0243 N.pl3 1 UNK -0.3360 3 N2 0.0126 -5.4284 0.0005 N.2 1 UNK -0.3767 4 C -0.0006 0.0270 -0.0010 C.2 1 UNK -0.0036 5 C1 -1.3113 0.7286 -0.0070 C.ar 1 UNK -0.0166 6 C2 1.3071 0.7336 0.0058 C.ar 1 UNK -0.0166 7 C3 0.0027 -1.3164 -0.0011 C.2 1 UNK -0.0166 8 C4 -1.8919 1.0434 -1.2175 C.ar 1 UNK -0.0522 9 C5 1.8866 1.0493 1.2168 C.ar 1 UNK -0.0522 10 C6 -1.9035 1.0415 1.1984 C.ar 1 UNK -0.0522 11 C7 1.8983 1.0504 -1.1991 C.ar 1 UNK -0.0522 12 C8 -1.2533 -2.0511 -0.0066 C.2 1 UNK -0.0521 13 C9 1.2622 -2.0450 0.0046 C.2 1 UNK -0.0521 14 C10 -3.7425 2.0297 -0.0177 C.ar 1 UNK 0.0292 15 C11 3.7334 2.0443 0.0182 C.ar 1 UNK 0.0292 16 C12 0.0094 -4.1444 0.0004 C.2 1 UNK 0.0374 17 C13 -3.1217 1.7016 -1.2229 C.ar 1 UNK -0.0401 18 C14 3.1139 1.7122 1.2230 C.ar 1 UNK -0.0401 19 C15 -3.1334 1.6997 1.1930 C.ar 1 UNK -0.0401 20 C16 3.1256 1.7133 -1.1929 C.ar 1 UNK -0.0401 21 C17 -1.2724 -3.3910 -0.0056 C.2 1 UNK -0.0379 22 C18 1.2876 -3.3849 0.0055 C.2 1 UNK -0.0379 23 C19 -5.9388 2.4786 1.0477 C.3 1 UNK 0.0004 24 C20 -5.3333 3.5930 -1.1064 C.3 1 UNK 0.0004 25 C21 5.9279 2.5031 -1.0466 C.3 1 UNK 0.0004 26 C22 5.3181 3.6125 1.1088 C.3 1 UNK 0.0004 27 C23 1.2809 -6.2019 0.0054 C.3 1 UNK 0.0069 28 C24 -1.2519 -6.2081 -0.0046 C.3 1 UNK 0.0069 29 H -1.4247 0.7963 -2.1039 H 1 UNK 0.0624 30 H1 1.4204 0.7995 2.1029 H 1 UNK 0.0624 31 H2 -1.4448 0.7931 2.0889 H 1 UNK 0.0624 32 H3 1.4407 0.8014 -2.0899 H 1 UNK 0.0624 33 H4 -2.1448 -1.5313 -0.0114 H 1 UNK 0.0624 34 H5 2.1512 -1.5209 0.0080 H 1 UNK 0.0624 35 H6 -3.5723 1.9458 -2.1186 H 1 UNK 0.0636 36 H7 3.5636 1.9570 2.1190 H 1 UNK 0.0636 37 H8 -3.5926 1.9425 2.0847 H 1 UNK 0.0636 38 H9 3.5839 1.9589 -2.0843 H 1 UNK 0.0636 39 H10 -2.1718 -3.8971 -0.0090 H 1 UNK 0.0638 40 H11 2.1893 -3.8868 0.0097 H 1 UNK 0.0638 41 H12 -5.5265 1.7936 1.7589 H 1 UNK 0.0428 42 H13 -6.8428 2.0727 0.6441 H 1 UNK 0.0428 43 H14 -6.1503 3.4098 1.5305 H 1 UNK 0.0428 44 H15 -4.5246 3.6377 -1.8057 H 1 UNK 0.0428 45 H16 -5.5195 4.5707 -0.7135 H 1 UNK 0.0428 46 H17 -6.2121 3.2336 -1.5998 H 1 UNK 0.0428 47 H18 5.5184 1.8174 -1.7586 H 1 UNK 0.0428 48 H19 6.8335 2.1002 -0.6435 H 1 UNK 0.0428 49 H20 6.1357 3.4357 -1.5283 H 1 UNK 0.0428 50 H21 4.5093 3.6532 1.8081 H 1 UNK 0.0428 51 H22 5.5005 4.5914 0.7171 H 1 UNK 0.0428 52 H23 6.1983 3.2559 1.6018 H 1 UNK 0.0428 53 H24 2.1107 -5.5263 0.0088 H 1 UNK 0.0451 54 H25 1.3262 -6.8181 -0.8682 H 1 UNK 0.0451 55 H26 1.3193 -6.8184 0.8791 H 1 UNK 0.0451 56 H27 -2.0850 -5.5366 -0.0078 H 1 UNK 0.0451 57 H28 -1.2942 -6.8248 0.8688 H 1 UNK 0.0451 58 H29 -1.2873 -6.8245 -0.8785 H 1 UNK 0.0451 @BOND 1 1 14 1 2 1 23 1 3 1 24 1 4 2 15 1 5 2 25 1 6 2 26 1 7 3 16 2 8 3 27 1 9 3 28 1 10 4 5 1 11 4 6 1 12 4 7 2 13 5 8 ar 14 5 10 ar 15 6 9 ar 16 6 11 ar 17 7 12 1 18 7 13 1 19 8 17 ar 20 9 18 ar 21 10 19 ar 22 11 20 ar 23 12 21 2 24 13 22 2 25 14 17 ar 26 14 19 ar 27 15 18 ar 28 15 20 ar 29 16 21 1 30 16 22 1 31 8 29 1 32 9 30 1 33 10 31 1 34 11 32 1 35 12 33 1 36 13 34 1 37 17 35 1 38 18 36 1 39 19 37 1 40 20 38 1 41 21 39 1 42 22 40 1 43 23 41 1 44 23 42 1 45 23 43 1 46 24 44 1 47 24 45 1 48 24 46 1 49 25 47 1 50 25 48 1 51 25 49 1 52 26 50 1 53 26 51 1 54 26 52 1 55 27 53 1 56 27 54 1 57 27 55 1 58 28 56 1 59 28 57 1 60 28 58 1