PUBCHEM-ZINC06199426 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0820 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0690 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1290 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.7710 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -6.2890 -1.1050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7540 -6.5870 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -6.9770 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -8.4260 -2.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -9.1620 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -10.4760 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -10.5700 -2.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 -11.3880 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -9.3120 -2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -9.0110 -2.3630 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1720 -9.7530 -1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -7.9320 -3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -11.4160 -1.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 -11.0430 -1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -11.8860 -1.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -9.7540 -1.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -9.5090 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -8.7980 -2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -7.6320 -2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -12.8280 -1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -6.6720 -0.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6260 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6020 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1420 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -4.4880 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -4.4630 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -6.6160 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -6.7500 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 -10.6130 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 -9.1030 -1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -10.0960 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -6.9890 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 -8.1450 -3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -7.8610 -4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -13.0470 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -13.4510 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -13.0360 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -6.4380 -1.0070 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 29 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 25 27 1 0 0 0 0 27 28 2 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M CHG 1 19 1 M END