PUBCHEM-ZINC05126148 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.8250 2.3160 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 1.0030 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 0.2290 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 0.7730 -0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 2.0960 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 2.8600 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -0.0550 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 0.3610 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 -0.7400 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 -1.7360 -0.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -2.6310 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -1.3090 -0.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 -0.8240 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5420 0.1440 -1.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5450 -1.9740 -0.5800 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9380 -2.0540 -0.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5540 -3.1650 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9640 -3.2460 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5900 -4.4290 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8020 -5.6600 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6500 -5.8710 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9180 -7.0260 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3190 -7.9760 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4570 -7.7750 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2040 -6.6270 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4250 -6.4160 1.5440 N 0 3 0 0 0 0 0 0 0 0 0 0 13.8290 -7.3000 2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0260 -5.3590 1.4760 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0680 2.9160 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 0.5820 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -0.7960 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 2.5220 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 3.8860 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 1.3340 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 -2.7460 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9910 -4.0250 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5380 -2.3620 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6690 -4.4720 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3360 -5.1300 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0280 -7.1900 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7400 -8.8800 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7640 -8.5210 1.6130 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END