PUBCHEM-ZINC05977237 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 57 0 0 1 0 0 0 0 0999 V2000 0.2960 -0.0510 4.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -1.4470 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -2.3640 4.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.4380 2.3360 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8110 -2.4620 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -0.7640 1.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 0.2530 1.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -1.3970 2.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 -0.8590 2.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5610 -0.0940 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -0.3010 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 1.2040 4.0440 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 1.4360 5.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 1.4250 5.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 2.8110 6.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 0.3520 6.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 -2.0290 1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -3.1850 2.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 -1.6570 0.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4770 -2.5990 0.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6900 -3.3720 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0190 -3.2350 -0.9940 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8830 -3.6430 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -4.3620 -0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 -2.2490 -1.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 -1.8240 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7550 -1.7820 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7570 -0.5520 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9040 -2.5050 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 -1.9990 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9490 -3.5150 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 0.6310 4.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 0.3890 4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.1040 5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -1.8580 4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -1.9880 3.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -3.3730 3.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -2.4480 5.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -2.2860 2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -1.0640 4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 -0.0450 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9950 2.1550 5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 1.6820 6.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9950 0.4390 5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 2.8660 6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 3.0200 7.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 3.6220 5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -0.6470 6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 0.5380 7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 0.3320 6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 -0.6780 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 -3.9880 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -4.8370 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 -5.1270 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -0.7550 1.6050 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3500 0.2490 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -1.1580 1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -0.7880 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 55 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 M CHG 1 55 1 M END