@MOLECULE ***** 30 30 0 0 0 SMALL GASTEIGER @ATOM 1 C 0.4240 -1.6670 0.2740 C.3 1 UNL1 0.1854 2 O 0.5540 -3.0180 -0.1740 O.3 1 UNL1 -0.3649 3 C 1.5660 -0.8260 -0.3000 C.3 1 UNL1 0.1342 4 O 2.8150 -1.3190 0.1900 O.3 1 UNL1 -0.3841 5 O -0.8270 -1.1370 -0.1700 O.3 1 UNL1 -0.3407 6 C -1.0720 0.2070 0.2470 C.3 1 UNL1 0.1132 7 C 0.0110 1.1240 -0.3280 C.3 1 UNL1 0.1121 8 O -0.1990 2.4600 0.1350 O.3 1 UNL1 -0.3865 9 C 1.3850 0.6320 0.1350 C.3 1 UNL1 0.1171 10 O 2.4070 1.4370 -0.4560 O.3 1 UNL1 -0.3744 11 C -2.4430 0.6570 -0.2600 C.3 1 UNL1 0.0761 12 O -3.4630 -0.1240 0.3660 O.3 1 UNL1 -0.3803 13 C 3.5890 1.5520 0.3380 C.3 1 UNL1 0.0370 14 C -4.7890 0.2170 -0.0410 C.3 1 UNL1 0.0366 15 H 0.4630 -1.6400 1.3630 H 1 UNL1 0.0935 16 H -0.1380 -3.6090 0.1520 H 1 UNL1 0.2126 17 H 1.5520 -0.8860 -1.3880 H 1 UNL1 0.0671 18 H 2.9940 -2.2400 -0.0450 H 1 UNL1 0.2101 19 H -1.0520 0.2590 1.3360 H 1 UNL1 0.0647 20 H -0.0360 1.1050 -1.4170 H 1 UNL1 0.0647 21 H -1.0530 2.8350 -0.1180 H 1 UNL1 0.2100 22 H 1.4490 0.6980 1.2220 H 1 UNL1 0.0650 23 H -2.5930 1.7100 -0.0180 H 1 UNL1 0.0586 24 H -2.4940 0.5220 -1.3400 H 1 UNL1 0.0586 25 H 3.3400 2.0020 1.2980 H 1 UNL1 0.0524 26 H 4.0150 0.5610 0.5000 H 1 UNL1 0.0524 27 H 4.3150 2.1780 -0.1800 H 1 UNL1 0.0524 28 H -4.9870 1.2600 0.2060 H 1 UNL1 0.0524 29 H -4.8880 0.0730 -1.1160 H 1 UNL1 0.0524 30 H -5.5040 -0.4210 0.4790 H 1 UNL1 0.0524 @BOND 1 2 1 1 2 1 5 1 3 1 3 1 4 5 6 1 5 4 3 1 6 3 9 1 7 6 11 1 8 6 7 1 9 12 11 1 10 12 14 1 11 9 7 1 12 9 10 1 13 7 8 1 14 10 13 1 15 1 15 1 16 2 16 1 17 3 17 1 18 4 18 1 19 6 19 1 20 7 20 1 21 8 21 1 22 9 22 1 23 11 23 1 24 11 24 1 25 13 25 1 26 13 26 1 27 13 27 1 28 14 28 1 29 14 29 1 30 14 30 1