IFLAB-ZINC00127473 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 -0.0020 1.3680 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0030 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -0.6700 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -2.0700 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -2.5650 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -1.7450 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -0.3690 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.1170 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 1.5200 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 2.1410 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 1.8850 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 3.0170 -0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 0.7380 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -2.9320 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -4.1820 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -4.5260 0.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -5.1350 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -6.4310 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -7.3160 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -6.9210 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -5.6380 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -4.7420 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9000 -7.8750 0.1010 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7800 -9.0060 0.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -7.5310 -0.4140 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9570 1.8730 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -0.5610 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -3.6360 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 -2.1840 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 3.2190 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 0.6960 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -2.6310 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -6.7410 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -8.3190 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -5.3360 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -3.7390 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 31 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 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END