PUBCHEM-ZINC00272723 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 1.3840 1.9440 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 0.4410 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -0.1120 0.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -0.3540 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -1.7520 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -2.4870 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -1.8500 -3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -0.4600 -3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 0.2830 -2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.6020 -4.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -1.7360 -6.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -2.6030 -7.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -4.3380 -6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -3.4700 -5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -4.2670 -8.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -4.8440 -9.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 -6.1860 -8.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -6.7150 -9.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -5.9020 -9.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -4.5620 -10.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 -4.0330 -9.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -2.5980 -9.9980 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8070 -1.9060 -10.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -2.1100 -9.5460 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3680 2.3580 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 2.2370 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 2.3250 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -2.2460 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -3.5650 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 0.0300 -4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 1.3600 -2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -1.1120 -5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -1.1020 -6.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -3.2180 -7.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -1.9630 -8.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -4.9620 -6.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -4.9720 -6.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -2.8560 -5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -4.1110 -4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -3.6300 -9.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -5.0770 -8.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -6.8200 -8.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 -7.7620 -9.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 -6.3160 -10.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2610 -3.9270 -10.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -3.4720 -7.4960 N 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 46 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 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