PUBCHEM-ZINC04534379 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0620 1.3170 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.0560 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -0.7420 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -0.0550 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 1.3180 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 2.0030 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -0.8030 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 -0.8850 -1.3490 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4560 -1.3300 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 -1.7370 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5030 -1.2650 -1.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 -3.0220 -0.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5120 -3.8440 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 -4.8410 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 -5.6500 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7410 -5.4690 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5180 -4.4770 -2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4030 -3.6680 -2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9340 -6.3380 -1.3880 N 0 3 0 0 0 0 0 0 0 0 0 0 10.1320 -7.2110 -0.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7180 -6.1790 -2.3070 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5320 0.4610 -1.8240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 1.2320 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 0.8090 -2.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 2.4690 -2.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 3.2420 -3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 4.5900 -3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 4.7630 -5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 5.9990 -5.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 7.0630 -4.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 6.8900 -3.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 5.6550 -2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 1.8530 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -0.5920 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -1.8140 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 1.8540 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 3.0760 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -0.2790 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 -1.8100 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -3.3780 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -4.9820 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0300 -6.4250 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2140 -4.3380 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2260 -2.8970 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4370 0.7980 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 2.7140 -4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 3.3760 -2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 3.9320 -5.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7090 6.1340 -6.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 8.0280 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 7.7210 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 5.5210 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 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 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 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 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END