PUBCHEM-ZINC02110154 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 -2.0310 -1.0640 -2.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -1.0430 -1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.6510 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -0.1820 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 1.1820 -2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 1.6240 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 0.7140 -4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -0.6490 -4.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -1.0950 -3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 1.2780 -5.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 0.4490 -6.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 1.3650 -7.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0960 3.6550 -7.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4340 4.8330 -6.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 4.4240 -5.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 3.4260 -4.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3620 2.1710 -5.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -0.6400 -0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -0.9870 1.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -1.1020 2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -0.8430 1.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -1.5210 3.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -2.1830 3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -2.5400 5.2850 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -1.8370 5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -1.3260 4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 -0.7150 5.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -0.6330 6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -1.1490 7.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -1.7560 7.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -0.6860 -3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -2.0890 -2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 -0.4510 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -1.3990 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 1.9040 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 2.6860 -4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -1.3940 -4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -2.1590 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.1070 -5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -0.2590 -6.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 0.8450 -7.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 1.7910 -7.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 3.9500 -7.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9970 3.2310 -7.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 5.6050 -6.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5270 5.2860 -5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3730 3.1780 -3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 3.8410 -3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 1.7350 -5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 1.4360 -4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.3510 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -1.1240 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -2.5030 2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -0.3010 4.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -0.1620 6.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -1.0830 8.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -2.1600 7.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 2.5460 -6.1960 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5770 2.9050 -5.7900 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 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 18 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 36 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 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 58 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 13 58 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END