IBS-ZINC04000059 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.2230 2.1580 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 0.7220 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 0.3760 -1.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -1.1700 -2.1260 P 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.4060 -3.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -1.7000 -1.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -1.3530 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -1.7670 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -1.9000 -1.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -1.5790 -2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -2.7030 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 -2.8580 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -2.8030 1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -3.8270 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -3.6190 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 -3.6830 -1.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2450 -4.6620 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7110 -3.5170 -2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8970 -4.5440 -3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8110 -4.3840 -4.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5160 -3.1960 -4.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3670 -2.1810 -3.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4770 -2.3650 -2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 2.8300 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 2.2800 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 2.4670 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.6140 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 0.0600 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -1.8710 -2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -0.2730 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -1.5190 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -1.2670 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 -2.8450 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -0.6260 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -1.4660 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 -2.5760 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -3.6940 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -2.0390 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -3.8160 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -2.9800 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -1.7970 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 -4.8400 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -3.7370 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2770 -4.3850 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -2.6520 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -5.4770 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9740 -5.1710 -4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2410 -3.0230 -5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4090 -1.5220 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 -2.6620 -1.0230 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9910 -1.7260 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 50 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 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END