PUBCHEM-ZINC01071871 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 -0.0380 1.5260 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.0190 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.7630 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1510 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -3.3910 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.5380 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -4.4800 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -3.2670 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.0870 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.7540 -1.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -0.4140 -2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.3010 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.1660 3.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 0.2830 4.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 0.8700 5.1010 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 1.1840 6.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 1.8200 4.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -0.4600 5.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -1.2860 6.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -2.3320 6.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7470 -2.5580 5.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 -1.7280 4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8040 -0.6710 4.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6430 -1.9650 3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6120 -1.2400 2.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5230 -2.9830 3.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4660 -3.1490 2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1320 -2.8420 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0660 -3.0070 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3310 -3.4760 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6670 -3.7820 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7360 -3.6250 2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0230 -4.2830 1.6840 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.8430 -4.4260 0.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3190 -4.5530 2.8340 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9840 1.9040 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 1.8910 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8720 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -3.4440 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -5.4970 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -5.3950 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -3.2330 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -1.0290 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 0.6650 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 0.5620 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -1.1320 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 0.2370 4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -1.1140 7.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -2.9740 7.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4520 -3.3750 5.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7770 -0.0220 3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5040 -3.6020 3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 -2.4760 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8070 -2.7680 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0600 -3.6030 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9980 -3.8680 3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 56 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 M CHG 1 33 1 M CHG 1 35 -1 M END