@MOLECULE FDBF07655 13 12 0 0 0 SMALL GASTEIGER @ATOM 1 O1 -1.3390 -0.4990 0.0120 O.3 1 FRG1 -0.3655 2 C1 -0.0190 1.5260 0.0100 C.3 1 FRG1 -0.0415 3 C5 0.0020 -0.0040 0.0020 C.3 1 FRG1 0.0462 4 C1 -1.4320 -1.9250 0.0050 C.3 1 FRG1 0.1337 5 C4 -2.8260 -2.3260 0.2580 C.1 1 FRG1 0.0907 6 N5 -3.9010 -2.6360 0.4520 N.1 1 FRG1 -0.1941 7 H 0.9848 1.8965 0.0025 H 1 FRG1 0.0252 8 H -0.5201 1.8712 0.8901 H 1 FRG1 0.0252 9 H -0.5364 1.8801 -0.8571 H 1 FRG1 0.0252 10 H 0.5194 -0.3581 0.8691 H 1 FRG1 0.0557 11 H 0.5031 -0.3492 -0.8781 H 1 FRG1 0.0557 12 H -0.8005 -2.3276 0.7692 H 1 FRG1 0.0718 13 H -1.1202 -2.2986 -0.9480 H 1 FRG1 0.0718 @BOND 1 3 2 1 2 3 1 1 3 4 1 1 4 4 5 1 5 5 6 3 6 2 7 1 7 2 8 1 8 2 9 1 9 3 10 1 10 3 11 1 11 4 12 1 12 4 13 1