@MOLECULE FDBF00200 29 29 0 0 0 SMALL GASTEIGER @ATOM 1 C1 0.7530 0.8470 0.7000 C.3 1 FRG1 -0.0401 2 C5 1.3310 1.9940 1.5410 C.3 1 FRG1 -0.0621 3 C1 -0.7850 0.9750 0.4560 C.3 1 FRG1 -0.0530 4 C5 -1.1020 2.2470 -0.3490 C.3 1 FRG1 -0.0650 5 C1 1.5750 0.7250 -0.6060 C.3 1 FRG1 -0.0250 6 C1 2.9370 0.0970 -0.4340 C.ar 1 FRG1 -0.0434 7 C2 4.0280 0.9060 -0.1580 C.ar 1 FRG1 -0.0133 8 C3 5.2870 0.3260 0.0000 C.ar 1 FRG1 0.1585 9 C4 5.4380 -1.0560 -0.1200 C.ar 1 FRG1 0.1582 10 C5 4.3310 -1.8570 -0.3990 C.ar 1 FRG1 -0.0163 11 C6 3.0720 -1.2770 -0.5570 C.ar 1 FRG1 -0.0549 12 O10 6.3610 1.1190 0.2740 O.3 1 FRG1 -0.5033 13 O12 6.6620 -1.6340 0.0330 O.3 1 FRG1 -0.5033 14 H 0.8465 -0.0660 1.2501 H 1 FRG1 0.0301 15 H 1.2426 2.9128 0.9998 H 1 FRG1 0.0233 16 H 2.3627 1.7998 1.7479 H 1 FRG1 0.0233 17 H 0.7906 2.0688 2.4615 H 1 FRG1 0.0233 18 H -1.1269 0.1199 -0.0888 H 1 FRG1 0.0265 19 H -1.2805 1.0336 1.4025 H 1 FRG1 0.0265 20 H -0.6112 2.1997 -1.2986 H 1 FRG1 0.0230 21 H -0.7561 3.1049 0.1888 H 1 FRG1 0.0230 22 H -2.1591 2.3212 -0.4971 H 1 FRG1 0.0230 23 H 1.0171 0.1284 -1.2972 H 1 FRG1 0.0316 24 H 1.7425 1.7230 -0.9536 H 1 FRG1 0.0316 25 H 3.9102 1.9275 -0.0702 H 1 FRG1 0.0658 26 H 4.4431 -2.8790 -0.4886 H 1 FRG1 0.0655 27 H 2.2495 -1.8651 -0.7634 H 1 FRG1 0.0621 28 H 6.2508 2.0461 0.3529 H 1 FRG1 0.2923 29 H 6.7551 -2.5627 -0.0491 H 1 FRG1 0.2923 @BOND 1 5 6 1 2 5 1 1 3 11 6 ar 4 11 10 ar 5 6 7 ar 6 10 9 ar 7 4 3 1 8 7 8 ar 9 9 8 ar 10 9 13 1 11 8 12 1 12 3 1 1 13 1 2 1 14 1 14 1 15 2 15 1 16 2 16 1 17 2 17 1 18 3 18 1 19 3 19 1 20 4 20 1 21 4 21 1 22 4 22 1 23 5 23 1 24 5 24 1 25 7 25 1 26 10 26 1 27 11 27 1 28 12 28 1 29 13 29 1