@MOLECULE FDBD00784 29 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.3610 -0.5442 1.0197 O.3 1 UNK -0.3097 2 O1 -1.2258 2.3520 -1.0905 O.3 1 UNK -0.3803 3 O2 -3.3947 1.5578 0.3599 O.3 1 UNK -0.3862 4 O3 -2.3334 -3.0676 0.2750 O.3 1 UNK -0.3924 5 O4 1.5399 2.2986 0.7076 O.2 1 UNK -0.1809 6 N 0.7200 0.1982 0.2563 N.am 1 UNK -0.0448 7 N1 3.0456 0.6838 0.1553 N.am 1 UNK 0.0647 8 N2 2.2632 -1.4889 -0.3176 N.2 1 UNK -0.0151 9 N3 4.5620 -0.9798 -0.4099 N.pl3 1 UNK -0.2482 10 C -1.3576 0.9761 -0.7980 C.3 1 UNK 0.1723 11 C1 -2.7891 0.5875 -0.4940 C.3 1 UNK 0.1183 12 C2 -2.6084 -0.6947 0.3070 C.3 1 UNK 0.1169 13 C3 -0.6446 0.5801 0.4835 C.3 1 UNK 0.2970 14 C4 -2.5096 -1.9398 -0.5642 C.3 1 UNK 0.0732 15 C5 1.7608 1.1291 0.3911 C.2 1 UNK 0.5867 16 C6 1.0581 -1.0888 -0.1008 C.2 1 UNK 0.3422 17 C7 3.2744 -0.5592 -0.1803 C.cat 1 UNK 0.4195 18 H -1.6963 2.5539 -1.9144 H 1 UNK 0.2103 19 H1 -3.5203 2.3858 -0.1296 H 1 UNK 0.2100 20 H2 -2.2690 -3.8683 -0.2687 H 1 UNK 0.2095 21 H3 5.3100 -0.3458 -0.3219 H 1 UNK 0.2413 22 H4 4.7367 -1.9152 -0.6624 H 1 UNK 0.2413 23 H5 -0.9591 0.5008 -1.6699 H 1 UNK 0.0715 24 H6 -3.3963 0.4980 -1.3705 H 1 UNK 0.0649 25 H7 -3.4588 -0.8298 0.9422 H 1 UNK 0.0648 26 H8 -0.6265 1.4163 1.1509 H 1 UNK 0.1440 27 H9 -3.4077 -2.0523 -1.1349 H 1 UNK 0.0584 28 H10 -1.6807 -1.8510 -1.2350 H 1 UNK 0.0584 29 H11 0.2960 -1.7774 -0.2012 H 1 UNK 0.1826 @BOND 1 1 12 1 2 1 13 1 3 2 10 1 4 3 11 1 5 4 14 1 6 5 15 2 7 6 13 1 8 6 15 am 9 6 16 1 10 7 15 1 11 7 17 2 12 8 16 2 13 8 17 1 14 9 17 1 15 10 11 1 16 10 13 1 17 11 12 1 18 12 14 1 19 2 18 1 20 3 19 1 21 4 20 1 22 9 21 1 23 9 22 1 24 10 23 1 25 11 24 1 26 12 25 1 27 13 26 1 28 14 27 1 29 14 28 1 30 16 29 1