PUBCHEM-ZINC02950676 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0310 1.4490 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -0.0550 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.8270 1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.2070 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.7430 0.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.9760 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.6540 -0.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.5710 -2.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -4.1820 -2.3290 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -4.4750 -3.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -4.8580 -1.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -4.4000 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -4.3010 -2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 -4.4720 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -4.7420 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 -4.8400 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -4.6740 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -4.9140 -0.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3980 -6.1830 0.2610 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -6.1340 1.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8140 -6.1480 0.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 -7.6640 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 -8.2960 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -9.4580 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -9.9870 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5920 -9.3550 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9040 -8.1960 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 -11.2300 -2.7050 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9860 -11.7870 -2.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8440 -11.6960 -3.5050 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9910 1.8260 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.8590 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.7520 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.3630 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.8370 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -2.0430 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -4.0910 -3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -4.3940 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -5.0500 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -4.7550 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 -4.2900 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 -7.8830 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -9.9520 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2940 -9.7680 -2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8500 -7.7040 -1.6850 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 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 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 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 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 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END