PUBCHEM-ZINC06008253 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 0 0 0 0 0 0999 V2000 2.4800 1.0460 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 -0.3690 -0.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.8320 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -2.3530 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -2.7070 0.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -4.0000 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -4.8740 0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -4.3560 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -5.6620 2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -6.6510 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -7.9260 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -8.8440 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -8.5180 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -7.2550 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -6.3300 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -6.9150 -0.9680 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7350 -5.8100 -0.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -7.7410 -1.8040 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8860 -3.3440 3.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -2.5420 4.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 1.3160 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 1.3530 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 1.5470 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -0.3700 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -0.5630 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.7150 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -2.8100 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -2.0100 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -5.9560 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -8.1800 2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -9.8260 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -5.3510 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -9.4340 -0.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -9.9920 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 3 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END