PUBCHEM-ZINC02047762 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.5140 0.3680 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 0.9910 -1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 1.3410 -1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 1.9150 -2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 2.1150 -3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 1.7400 -4.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 1.2020 -2.9940 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2970 2.7330 -5.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 2.8290 -6.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 3.4440 -7.6500 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 4.8050 -7.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 2.3100 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 4.1010 -1.9500 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8020 3.2430 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 5.2080 -0.8960 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6670 6.0460 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 4.6680 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 5.6470 -0.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7770 4.6110 -3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0810 4.6360 -4.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 1.1250 -0.4990 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6170 -0.7160 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 0.6360 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 0.7340 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 1.8930 -4.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 2.1110 -5.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 3.7290 -4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 2.2270 -3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 1.6500 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7290 4.4290 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9350 5.4230 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3460 3.7690 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2560 4.9510 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 0.9520 -3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 3.5160 -8.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 2.5050 -8.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8190 3.6970 -2.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 3.8230 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0480 5.0380 -3.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3620 5.3570 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 1.5960 -8.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 3.8770 -9.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 13 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 35 42 1 0 0 0 0 36 41 1 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 7 1 M CHG 1 21 -1 M END