PUBCHEM-ZINC02115114 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 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 3 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -1.9720 1.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -2.6430 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -2.0370 3.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -4.1470 2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -4.6460 3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -4.7940 4.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -5.2520 5.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -5.5620 5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -5.4150 4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -4.9620 3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 -6.0520 7.0250 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3440 -6.1810 8.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 -6.3250 6.9580 O 0 5 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 -1.5240 -0.3410 -2.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -1.1640 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -1.2140 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -2.3560 -3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -2.4020 -4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -1.3060 -5.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 -0.1660 -4.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -0.1210 -3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -1.3550 -6.5190 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.3270 -2.3600 -7.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 -0.3900 -6.9880 O 0 5 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 1.7880 -0.2080 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -2.4580 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -4.4500 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -4.5700 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -4.5510 4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -5.3660 6.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -5.6580 4.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -4.8500 2.5720 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 -3.4790 -2.1660 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 -0.5030 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -3.2110 -2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 -3.2930 -5.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 0.6900 -4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 0.7690 -2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 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 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 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 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 28 1 M CHG 1 30 -1 M END