IBS-ZINC02291433 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -2.7480 0.0370 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 -1.8260 -0.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -4.0380 -0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6250 -2.9850 1.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7480 -3.5800 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -4.0600 1.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7670 -4.6390 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6360 -5.0900 0.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8560 -4.7020 2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8580 -5.2380 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7760 -5.2100 5.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7130 -5.7130 6.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2210 -5.4680 7.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0320 -4.8410 7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7650 -4.6910 5.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3650 -3.9300 3.5420 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5410 -3.9770 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7150 -5.6840 3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6430 -6.2000 5.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7020 -5.7320 8.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3980 -4.5160 7.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 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 2 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 M END