OTAVA-ZINC01287523 MOE2007 3D Structure written by MMmdl. 42 45 0 0 0 0 0 0 0 0999 V2000 -3.7290 2.1070 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 1.3740 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -0.0130 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.7010 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 -0.0170 1.3990 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 2.0840 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.1250 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 3.3450 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 1.3530 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -0.0240 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -0.6630 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -0.8150 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -2.1800 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 -2.5050 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 -1.3420 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -0.3250 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 1.9610 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 2.2410 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 1.9510 -2.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5270 2.9020 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 3.2510 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4650 3.8620 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9710 4.1270 -1.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3360 3.8200 -2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 3.2020 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -2.2080 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 2.2790 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 3.0640 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 1.5090 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -0.5600 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 3.1630 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -2.8730 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4620 -3.4990 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8010 -1.2460 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 3.0410 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 4.1310 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 4.0560 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 2.9540 -3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -2.5770 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -2.5700 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -2.5680 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 18 19 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 26 2 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M END