PUBCHEM-ZINC03735580 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 0.9120 1.4020 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -0.0080 -0.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -0.4590 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 0.3340 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -0.2620 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -1.6510 3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -2.4680 2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -1.8530 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -3.9790 2.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7560 -4.4190 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -4.5230 3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -5.5440 4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -5.7670 4.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -6.6470 5.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -6.6120 6.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -5.7060 5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -4.8200 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -4.8720 4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -4.1310 3.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -3.4070 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -7.5200 7.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 -7.5520 8.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -8.6190 9.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 -8.3220 10.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -9.3140 11.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 -10.6130 11.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 -10.9230 9.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -9.9330 8.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -6.2110 4.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -5.9600 2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 1.8460 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 1.5920 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 1.8670 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 1.4170 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 0.3620 4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -2.0810 4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -2.4510 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -7.3550 6.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -5.6550 6.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 -4.1180 4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -6.5840 8.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 -7.7870 7.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -7.3150 10.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -9.0730 12.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -11.3860 11.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -11.9380 9.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -10.1930 7.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -5.8100 5.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -7.2900 4.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -6.2190 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -6.5190 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -4.5000 2.5720 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9950 -4.3250 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 -3.9370 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 52 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END