@MOLECULE FDBF04053 21 20 0 0 0 SMALL GASTEIGER @ATOM 1 C1 11.8760 -4.5190 -1.7160 C.3 1 FRG1 -0.0542 2 C1 11.3610 -5.2960 -0.4850 C.3 1 FRG1 -0.0652 3 C1 14.5370 -3.0580 -1.4500 C.3 1 FRG1 -0.0467 4 C1 13.2110 -5.0850 -2.2400 C.3 1 FRG1 -0.0351 5 C1 14.3790 -4.5870 -1.3680 C.3 1 FRG1 0.0188 6 N1 15.6090 -5.3040 -1.6480 N.am 1 FRG1 -0.3285 7 C2 16.6330 -5.1950 -0.7810 C.2 1 FRG1 0.1251 8 O3 17.6650 -5.9650 -1.1380 O.co2 1 FRG1 -0.5318 9 O4 16.6280 -4.4880 0.2160 O.co2 1 FRG1 -0.5318 10 H 11.1449 -4.5818 -2.4947 H 1 FRG1 0.0263 11 H 12.0409 -3.5039 -1.4205 H 1 FRG1 0.0263 12 H 11.1877 -6.3169 -0.7545 H 1 FRG1 0.0230 13 H 10.4469 -4.8573 -0.1431 H 1 FRG1 0.0230 14 H 12.0915 -5.2522 0.2956 H 1 FRG1 0.0230 15 H 13.5991 -2.5904 -1.2342 H 1 FRG1 0.0247 16 H 14.8537 -2.7845 -2.4348 H 1 FRG1 0.0247 17 H 15.2681 -2.7363 -0.7380 H 1 FRG1 0.0247 18 H 13.3603 -4.7615 -3.2489 H 1 FRG1 0.0283 19 H 13.1766 -6.1537 -2.2002 H 1 FRG1 0.0283 20 H 14.1381 -4.8076 -0.3491 H 1 FRG1 0.0495 21 H 15.6930 -5.8595 -2.4565 H 1 FRG1 0.1474 @BOND 1 4 1 1 2 4 5 1 3 1 2 1 4 6 5 1 5 6 7 am 6 3 5 1 7 8 7 ar 8 7 9 ar 9 1 10 1 10 1 11 1 11 2 12 1 12 2 13 1 13 2 14 1 14 3 15 1 15 3 16 1 16 3 17 1 17 4 18 1 18 4 19 1 19 5 20 1 20 6 21 1