PUBCHEM-ZINC04532728 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0800 0.8420 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 0.9870 2.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 1.4900 3.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 2.9930 3.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 3.6410 5.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 5.0300 5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 5.7620 3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 5.1400 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 3.7390 2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 3.0610 1.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3670 3.2740 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 3.5990 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 3.3970 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 3.9570 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 3.1370 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 3.6470 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 4.9930 -3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7770 5.8290 -2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1470 5.3070 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 7.1210 -2.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 8.0050 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 5.5350 -4.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 2.9330 -4.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 1.5500 -4.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 7.1290 3.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 5.7870 6.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 5.0830 7.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -0.2390 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 1.1580 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.1060 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 1.3140 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -0.1060 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 1.0850 3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 1.1250 4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 3.0330 5.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 5.7720 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 4.6700 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 3.1480 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 2.3350 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 3.8820 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 2.1000 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 5.9270 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 8.9780 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 7.6530 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 8.1460 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 6.4690 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9070 1.1360 -5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 1.3950 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 1.0140 -3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 7.3550 4.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 5.8230 8.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 4.4450 7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 4.5030 7.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 1.5250 1.3910 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7760 1.2620 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 54 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 54 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END