@MOLECULE FDBF03616 30 31 0 0 0 SMALL GASTEIGER @ATOM 1 N1 7.8050 0.7240 0.1330 N.pl3 1 FRG1 -0.3390 2 C3 8.7390 0.2670 1.1420 C.3 1 FRG1 0.0001 3 C7 8.2990 1.5040 -0.9840 C.3 1 FRG1 0.0001 4 N1 2.4160 -0.5430 0.5100 N.ar 1 FRG1 -0.3499 5 C2 3.7240 -0.2360 0.4270 C.ar 1 FRG1 0.0451 6 C3 4.3060 -0.0600 -0.8480 C.ar 1 FRG1 -0.0183 7 C4 5.6700 0.2610 -0.9310 C.3 1 FRG1 0.0125 8 C5 6.4350 0.4020 0.2290 C.2 1 FRG1 0.0104 9 C6 5.8490 0.2260 1.4830 C.2 1 FRG1 -0.0426 10 C7 4.4960 -0.0930 1.5840 C.2 1 FRG1 -0.0365 11 C11 3.4960 -0.2130 -1.9810 C.ar 1 FRG1 -0.0549 12 C12 2.1500 -0.5310 -1.8400 C.ar 1 FRG1 -0.0453 13 C13 1.6310 -0.6920 -0.5660 C.ar 1 FRG1 0.0048 14 C16 1.7940 -0.7290 1.8350 C.3 1 FRG1 0.0119 15 H 9.7232 0.6086 0.8979 H 1 FRG1 0.0427 16 H 8.7311 -0.8024 1.1771 H 1 FRG1 0.0427 17 H 8.4525 0.6573 2.0962 H 1 FRG1 0.0427 18 H 7.4845 1.7576 -1.6298 H 1 FRG1 0.0427 19 H 9.0204 0.9308 -1.5280 H 1 FRG1 0.0427 20 H 8.7569 2.3995 -0.6189 H 1 FRG1 0.0427 21 H 5.7351 1.1908 -1.4565 H 1 FRG1 0.0375 22 H 6.0939 -0.6043 -1.3962 H 1 FRG1 0.0375 23 H 6.4184 0.3322 2.3371 H 1 FRG1 0.0633 24 H 4.0642 -0.2236 2.5122 H 1 FRG1 0.0639 25 H 3.8997 -0.0893 -2.9227 H 1 FRG1 0.0621 26 H 1.5479 -0.6451 -2.6703 H 1 FRG1 0.0632 27 H 0.6337 -0.9281 -0.4445 H 1 FRG1 0.0809 28 H 0.7579 -0.9663 1.7125 H 1 FRG1 0.0456 29 H 1.8886 0.1727 2.4032 H 1 FRG1 0.0456 30 H 2.2845 -1.5283 2.3502 H 1 FRG1 0.0456 @BOND 1 11 12 ar 2 11 6 ar 3 12 13 ar 4 3 1 1 5 7 6 1 6 7 8 1 7 6 5 ar 8 13 4 ar 9 1 8 1 10 1 2 1 11 8 9 2 12 5 4 ar 13 5 10 2 14 4 14 1 15 9 10 1 16 2 15 1 17 2 16 1 18 2 17 1 19 3 18 1 20 3 19 1 21 3 20 1 22 7 21 1 23 7 22 1 24 9 23 1 25 10 24 1 26 11 25 1 27 12 26 1 28 13 27 1 29 14 28 1 30 14 29 1 31 14 30 1