IBS-ZINC04777027 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 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 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4320 -2.1120 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -3.9660 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0830 -4.2980 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -4.3690 -1.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -3.8590 -2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -2.7010 -2.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -1.9800 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -0.9350 -1.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -4.5450 -3.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -4.0160 -4.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -4.0320 -5.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -5.7720 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -5.8320 -3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -5.4840 -7.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -6.9280 -7.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -7.7140 -8.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -9.0390 -8.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -9.5780 -8.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -8.7920 -7.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -7.4660 -7.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 -4.5680 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 -5.0310 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 -5.5830 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6330 -5.6730 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3410 -5.2090 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 -4.6530 -0.7100 C 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 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 -1.6070 -4.9770 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -4.6420 -4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 -2.9940 -4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -3.7470 -6.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -3.3260 -5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -5.0390 -4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -6.7520 -5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -6.0100 -2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -6.6350 -3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -4.9080 -7.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -5.0910 -8.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -7.2930 -8.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -9.6530 -9.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -10.6130 -8.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -9.2130 -6.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -6.8510 -6.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -4.9610 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 -5.9460 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6000 -6.1050 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0810 -5.2800 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -4.2880 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -5.3840 -6.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 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 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 59 1 0 0 0 0 19 45 1 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 20 48 1 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 M END