@MOLECULE C93 34 35 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.4970 -1.4940 -0.0530 O.2 1 UNL1 -0.2451 2 C -3.5980 -0.2830 -0.0350 C.2 1 UNL1 0.3377 3 O -4.8170 0.2910 -0.0340 O.3 1 UNL1 -0.4771 4 C -2.3840 0.5590 -0.0100 C.ar 1 UNL1 0.0746 5 C -2.4950 1.9450 0.0160 C.ar 1 UNL1 -0.0469 6 C -1.3580 2.7350 0.0400 C.ar 1 UNL1 -0.0592 7 C -0.1040 2.1590 0.0400 C.ar 1 UNL1 -0.0398 8 C 0.0340 0.7740 0.0140 C.ar 1 UNL1 0.0446 9 C -1.1070 -0.0380 -0.0050 C.ar 1 UNL1 0.0937 10 C -0.9740 -1.5060 -0.0270 C.2 1 UNL1 0.3394 11 O -0.9080 -2.0950 -1.0880 O.2 1 UNL1 -0.2450 12 O -0.9250 -2.1950 1.1300 O.3 1 UNL1 -0.4771 13 N 1.2970 0.2000 0.0120 N.pl3 1 UNL1 -0.3291 14 C 2.0510 0.5830 1.2120 C.3 1 UNL1 0.0145 15 C 3.3770 -0.1800 1.2490 C.3 1 UNL1 -0.0110 16 C 4.1850 0.1490 -0.0100 C.3 1 UNL1 0.0581 17 O 5.3990 -0.6040 -0.0090 O.3 1 UNL1 -0.3917 18 C 3.3580 -0.2150 -1.2460 C.3 1 UNL1 -0.0110 19 C 2.0330 0.5490 -1.2110 C.3 1 UNL1 0.0145 20 H -5.5810 -0.3010 -0.0470 H 1 UNL1 0.2954 21 H -3.4710 2.4070 0.0170 H 1 UNL1 0.0626 22 H -1.4540 3.8100 0.0600 H 1 UNL1 0.0618 23 H 0.7750 2.7860 0.0590 H 1 UNL1 0.0636 24 H -0.8370 -3.1560 1.0650 H 1 UNL1 0.2954 25 H 2.2490 1.6550 1.1900 H 1 UNL1 0.0464 26 H 1.4680 0.3400 2.1000 H 1 UNL1 0.0464 27 H 3.9430 0.1160 2.1320 H 1 UNL1 0.0305 28 H 3.1800 -1.2510 1.2860 H 1 UNL1 0.0305 29 H 4.4170 1.2140 -0.0260 H 1 UNL1 0.0594 30 H 5.9610 -0.4450 -0.7790 H 1 UNL1 0.2098 31 H 3.9100 0.0570 -2.1460 H 1 UNL1 0.0305 32 H 3.1610 -1.2870 -1.2500 H 1 UNL1 0.0305 33 H 1.4350 0.2820 -2.0820 H 1 UNL1 0.0464 34 H 2.2310 1.6210 -1.2210 H 1 UNL1 0.0464 @BOND 1 1 2 2 2 5 6 ar 3 5 4 ar 4 6 7 ar 5 2 4 1 6 2 3 1 7 4 9 ar 8 7 8 ar 9 9 8 ar 10 9 10 1 11 8 13 1 12 19 13 1 13 19 18 1 14 11 10 2 15 10 12 1 16 13 14 1 17 14 15 1 18 18 16 1 19 16 15 1 20 16 17 1 21 3 20 1 22 5 21 1 23 6 22 1 24 7 23 1 25 12 24 1 26 14 25 1 27 14 26 1 28 15 27 1 29 15 28 1 30 16 29 1 31 17 30 1 32 18 31 1 33 18 32 1 34 19 33 1 35 19 34 1