IFLAB-ZINC02684677 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8080 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -2.3220 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -3.6780 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5460 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -4.0230 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6650 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -6.0000 -1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -6.4500 -2.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -6.9310 -0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -8.3190 -1.2100 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8820 -8.9130 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -10.2210 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -10.9120 -1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -10.2420 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -8.9350 -1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -12.3150 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -12.8810 -2.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -12.9630 -3.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -14.3500 -3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -14.8390 -4.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -14.6780 -5.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -15.1260 -6.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -15.7350 -5.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -15.8960 -4.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -15.4520 -3.7670 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -1.6520 -3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -4.0770 -3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -4.6880 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -2.2610 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -6.7440 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -6.7600 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -8.3710 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 -10.7020 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -10.7390 -2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -8.4110 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -12.5110 -3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -14.4040 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -14.9760 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -14.2030 -6.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -15.0000 -7.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -16.0840 -6.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -16.3720 -4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -15.5820 -2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 M CHG 1 13 1 M END