@MOLECULE FDBF04962 29 29 0 0 0 SMALL GASTEIGER @ATOM 1 O1 0.5320 -9.2080 -1.4900 O.3 1 FRG1 -0.3821 2 C1 0.0440 -8.0650 -0.7840 C.3 1 FRG1 0.0564 3 C1 1.3730 -8.8890 -2.6010 C.3 1 FRG1 0.0365 4 O1 -2.7600 -4.0180 3.1620 O.3 1 FRG1 -0.5068 5 C1 -0.8400 -8.5220 0.3780 C.3 1 FRG1 0.0135 6 C3 -0.0210 -9.3980 1.3280 C.3 1 FRG1 -0.0537 7 C7 -2.0210 -9.3270 -0.1670 C.3 1 FRG1 -0.0537 8 C1 -2.2970 -5.1050 2.4900 C.ar 1 FRG1 0.1169 9 C2 -1.4730 -4.9400 1.3860 C.ar 1 FRG1 -0.0199 10 C3 -0.9990 -6.0470 0.7080 C.ar 1 FRG1 -0.0545 11 C4 -1.3540 -7.3170 1.1230 C.ar 1 FRG1 -0.0393 12 C5 -2.1790 -7.4840 2.2200 C.ar 1 FRG1 -0.0545 13 C6 -2.6510 -6.3810 2.9040 C.ar 1 FRG1 -0.0199 14 H -0.5291 -7.4531 -1.4488 H 1 FRG1 0.0568 15 H 0.8702 -7.5016 -0.4033 H 1 FRG1 0.0568 16 H 1.6959 -9.7924 -3.0749 H 1 FRG1 0.0523 17 H 2.2260 -8.3421 -2.2572 H 1 FRG1 0.0523 18 H 0.8267 -8.2938 -3.3025 H 1 FRG1 0.0523 19 H -2.5203 -3.1567 2.8815 H 1 FRG1 0.2921 20 H 0.3439 -10.2535 0.7990 H 1 FRG1 0.0239 21 H -0.6394 -9.7181 2.1404 H 1 FRG1 0.0239 22 H 0.8053 -8.8351 1.7091 H 1 FRG1 0.0239 23 H -2.5939 -8.7144 -0.8314 H 1 FRG1 0.0239 24 H -2.6395 -9.6473 0.6453 H 1 FRG1 0.0239 25 H -1.6558 -10.1823 -0.6961 H 1 FRG1 0.0239 26 H -1.2144 -3.9917 1.0715 H 1 FRG1 0.0654 27 H -0.3797 -5.9255 -0.1085 H 1 FRG1 0.0622 28 H -2.4421 -8.4333 2.5277 H 1 FRG1 0.0622 29 H -3.2668 -6.5058 3.7227 H 1 FRG1 0.0654 @BOND 1 3 1 1 2 1 2 1 3 2 5 1 4 7 5 1 5 5 11 1 6 5 6 1 7 10 11 ar 8 10 9 ar 9 11 12 ar 10 9 8 ar 11 12 13 ar 12 8 13 ar 13 8 4 1 14 2 14 1 15 2 15 1 16 3 16 1 17 3 17 1 18 3 18 1 19 4 19 1 20 6 20 1 21 6 21 1 22 6 22 1 23 7 23 1 24 7 24 1 25 7 25 1 26 9 26 1 27 10 27 1 28 12 28 1 29 13 29 1