PUBCHEM-ZINC04619721 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.7000 -0.6320 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -0.3510 1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -0.3380 -1.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.2790 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -3.0370 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -4.1780 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -4.9700 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -4.1650 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -3.0240 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -6.1130 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -7.0000 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -8.1290 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -8.3760 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -7.4960 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -6.3680 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5040 -9.5870 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4600 -10.3630 -0.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 -9.8060 0.9410 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -3.4490 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -2.3800 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -4.8150 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -3.7620 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -4.7930 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 -3.7500 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -2.3580 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -3.4350 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -6.8060 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 -8.8180 -1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3640 -7.6920 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 -5.6830 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 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 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END