IBS-ZINC02253478 MOE2007 3D Structure written by MMmdl. 47 50 0 0 0 0 0 0 0 0999 V2000 -6.2270 -2.9390 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1610 -1.4450 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 -0.7680 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 0.6290 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 1.3320 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2520 2.7370 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4870 3.3870 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6830 2.6680 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9030 3.3620 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1150 2.6800 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1200 1.2940 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9130 0.5900 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6550 1.2530 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3760 0.6020 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 1.3040 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 0.6510 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 1.6880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 1.0390 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 1.7330 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 3.1320 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 3.7860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 3.0480 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 1.6580 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 1.0110 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7470 -3.3260 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 -3.3480 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2630 -3.2910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -1.3530 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 3.3730 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4980 4.4770 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9240 4.4510 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0520 3.2310 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0660 0.7560 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0030 -0.4920 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 2.3150 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 0.0200 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 0.0090 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 2.3220 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 2.3300 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 0.0270 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 3.7440 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 4.8720 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 3.5550 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 1.0750 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -0.0760 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3030 -0.7470 0.0280 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.1660 -1.2820 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 46 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 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 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END