PUBCHEM-ZINC06878965 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -1.4170 2.8380 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 1.4050 1.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 0.4830 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 0.7750 0.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -0.3000 0.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 -1.4660 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -1.2650 1.0780 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -3.0080 0.7200 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2880 -2.5140 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1560 -3.7420 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5910 -4.2340 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 -5.3450 1.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6890 -6.3070 0.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.9420 -7.0940 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9720 -6.7350 1.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.0510 -7.8080 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3710 -5.9550 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6440 -5.9040 3.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1890 -6.1460 0.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.3710 -6.7760 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4450 -7.7830 1.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.5820 -6.2420 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5280 -5.1050 -0.6700 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.2840 -4.4520 -0.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3740 -3.2150 -1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8500 -7.0000 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0670 -6.5460 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1020 -7.3740 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6240 -8.7770 0.4940 S 0 0 0 0 0 0 0 0 0 0 0 0 -14.9770 -8.1840 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.3840 -7.1570 -0.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8880 -5.2980 -1.1470 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.4250 -4.2520 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1750 -3.6110 2.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6750 -3.9720 3.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 3.4000 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 3.0490 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 3.1330 1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 1.0990 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6420 -1.8790 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3360 -1.9630 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1440 -5.3020 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0210 -2.5290 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3800 -2.7780 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7880 -3.3950 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1360 -5.6180 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1810 -8.6940 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.5720 -6.3560 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.0860 -7.8070 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5550 -3.4030 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5680 -4.8370 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 -2.6400 2.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -2.2620 3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 42 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 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 30 2 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 33 50 1 0 0 0 0 33 51 1 0 0 0 0 34 35 2 0 0 0 0 34 52 1 0 0 0 0 52 53 1 0 0 0 0 M END