IFLAB-ZINC00189303 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 0.8050 1.3180 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 -0.2030 -0.8520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8500 -0.5360 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -0.6090 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -2.0760 0.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -2.7530 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -2.2430 -1.5330 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7780 -2.5840 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -0.8140 -1.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -2.7820 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -2.7790 1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -2.2160 2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -4.2270 1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -5.0960 1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -6.4370 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -7.5750 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -8.8070 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -8.9730 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -7.8870 1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -6.6090 1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -5.0500 1.5460 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -9.9850 2.6940 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3260 -9.8470 2.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -11.0920 2.7760 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6430 1.7830 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 1.6060 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 1.6500 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -0.2660 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.1660 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -3.8300 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -2.5260 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -2.4390 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -2.4190 -3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -3.8720 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 -4.7870 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 -7.4640 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -9.9580 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -8.0210 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END