NCID-ZINC01631659 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 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 3 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2560 -0.1270 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -2.0430 1.2580 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2350 -2.4290 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -2.5090 1.2200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2680 -2.1640 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -1.9240 -0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9430 -2.3010 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.4990 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 -2.3190 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 -1.5640 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0390 -2.2150 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -3.4920 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -3.5030 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7310 -4.6030 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -5.6640 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -5.6470 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -4.5790 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 -6.8330 -2.2030 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6600 -6.8540 -2.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -7.7740 -2.5710 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7960 -3.9360 1.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -2.5240 2.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 -0.0650 1.2050 O 0 0 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 -3.7730 -0.5880 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0190 -1.8640 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -4.6250 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 -6.4860 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5640 -4.5720 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -4.3730 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -2.2590 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 0.8970 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 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 22 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 36 1 0 0 0 0 26 37 1 0 0 0 0 27 38 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END