PUBCHEM-ZINC04781948 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 64 0 0 1 0 0 0 0 0999 V2000 2.3390 -4.4210 3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -3.7420 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -4.6420 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -3.9510 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -4.8560 -0.2160 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8460 -5.7460 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -5.3150 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -4.1950 -2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -4.1490 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 -2.9230 -0.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -4.9220 -0.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -4.2010 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -3.6640 -2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 -2.7140 -4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8870 -1.9150 -4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8250 -0.6280 -4.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 -0.7360 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4160 -1.4730 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -6.3880 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -6.8340 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 -6.1610 1.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 -8.0570 0.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 -8.7530 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -9.9160 2.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 -10.4150 3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -9.5990 4.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 -8.1850 3.2480 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -11.7300 4.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -3.7610 3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -5.3470 3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -4.6660 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -3.4810 3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -2.8050 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -4.9040 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -5.5770 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -3.6420 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -3.0230 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -6.0290 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -5.8590 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -4.6100 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -3.4550 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -3.6850 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 -4.8630 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 -3.3800 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -3.0230 -2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -4.5090 -3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 -3.7210 -4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 -2.1980 -4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0020 -1.7580 -5.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7770 -2.4480 -4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6770 0.2790 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5840 -1.2390 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5290 -0.9520 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3530 -1.6020 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -6.7560 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -6.8400 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -8.5490 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 -9.7620 5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -11.6550 4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 -12.0800 4.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -12.4810 3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4200 -2.8590 -3.0570 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.2300 -3.3800 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 13 62 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 62 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 18 62 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 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 57 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END