PUBCHEM-ZINC06358311 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.6430 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -0.3410 -2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -1.1090 -1.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -1.2520 -2.3930 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7790 -0.4650 -3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5840 -1.2650 -2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -2.7320 -1.7470 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8890 -2.8240 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 -3.5410 -2.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -2.6540 -3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -4.8730 -2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 -5.5060 -1.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 -5.5770 -2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 -7.3500 -2.3740 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -8.0130 -3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1660 -3.1870 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1740 -3.8540 -3.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3280 -2.8510 -1.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3180 -2.0440 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6000 -3.2930 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9780 -4.6300 -1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2560 -5.1610 -0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1200 -5.2350 -2.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 -1.3500 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 -0.5920 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 -1.0030 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -2.6420 -4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -2.9740 -2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -5.4310 -3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -5.1660 -2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -9.0900 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -7.8060 -4.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -7.5420 -2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3570 -0.9870 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1830 -2.3000 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4050 -2.2460 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3760 -2.5630 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4980 -3.3850 -3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6970 -4.8100 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3630 -6.0950 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 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 35 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END