PUBCHEM-ZINC05729919 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.8090 1.6660 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 0.3330 0.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9110 -0.3980 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 0.5620 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -0.7000 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.2830 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -1.5430 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -0.4670 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -0.6530 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 0.2600 -3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 1.0190 -2.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.1960 -4.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -0.7150 -5.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -1.6530 -5.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -2.5910 -6.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -3.5130 -6.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -3.3830 -5.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -2.4410 -4.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -1.5640 -4.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -4.5800 -7.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -4.3340 -8.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -5.3400 -9.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -6.5910 -9.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -6.8400 -8.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -5.8370 -7.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -2.7090 -7.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 2.3350 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 1.5250 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 2.1770 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 1.3450 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 0.9280 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -0.4730 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -1.4400 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -0.5940 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 -2.2190 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8990 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -2.2800 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 0.4310 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -1.3030 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 0.8980 -5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 -0.7670 -6.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -3.9980 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -3.3610 -8.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -5.1500 -10.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -7.3740 -9.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -7.8170 -8.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -6.0450 -6.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -3.4170 -8.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.2610 -1.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3020 0.4360 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 49 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 19 2 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END