D00PYP -OEChem-10101305032D 87 90 0 1 0 0 0 0 0999 V2000 9.3424 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.3424 2.5102 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.8690 8.4610 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.7050 7.9917 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 7.4235 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 10.4235 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.4641 5.8790 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.4404 10.6836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2651 9.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7215 11.9643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9895 11.9576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6723 9.4852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6155 11.4580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3933 11.4476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9010 6.5860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7292 9.9643 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4497 8.2582 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 8.4235 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 7.4235 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 8.3888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8665 6.8466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.4457 9.0077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.0724 9.7355 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7331 8.9643 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.7414 8.9640 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.7375 9.9723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8613 10.4610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9972 9.9576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0010 8.9576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 10.4543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 8.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.4235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 8.4235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 6.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8574 11.4609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4152 8.5188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 8.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 8.4235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 6.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 9.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 9.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1236 7.8129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5331 9.9443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 10.4235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3972 10.4476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 10.4581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5331 8.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6155 7.3889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0890 8.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4756 6.8789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8673 7.4456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4444 8.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6439 5.6196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9545 8.1437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3135 9.2029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3900 9.0629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7912 8.3742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2903 7.6590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5259 10.9308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7289 10.9277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6675 9.3984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8705 9.3984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3471 6.8408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7456 7.5311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1909 9.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7924 8.3158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8705 6.4485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6675 6.4485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 7.4604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.6134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 6.3865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 11.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0688 8.5906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7191 12.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0062 7.5036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3967 6.8087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0849 6.7642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6944 7.4590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8360 6.8264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0448 5.7790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4846 5.0204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2431 5.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6849 9.6396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8491 10.3139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3424 2.5102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3424 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 87 1 0 0 0 0 2 86 1 0 0 0 0 3 24 1 0 0 0 0 3 29 1 0 0 0 0 4 52 1 0 0 0 0 4 53 1 0 0 0 0 5 39 1 0 0 0 0 6 42 1 0 0 0 0 7 51 1 0 0 0 0 8 26 2 0 0 0 0 9 30 1 0 0 0 0 9 46 1 0 0 0 0 10 35 1 0 0 0 0 10 75 1 0 0 0 0 11 35 2 0 0 0 0 12 36 2 0 0 0 0 13 47 2 0 0 0 0 14 46 2 0 0 0 0 15 21 1 0 0 0 0 15 54 1 0 0 0 0 16 24 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 25 17 1 1 0 0 0 17 36 1 0 0 0 0 17 59 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 37 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 40 1 0 0 0 0 20 38 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 43 2 0 0 0 0 22 50 1 0 0 0 0 22 53 2 0 0 0 0 23 53 1 0 0 0 0 23 84 1 0 0 0 0 23 85 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 6 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 27 28 2 0 0 0 0 27 35 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 33 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 34 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 34 68 1 0 0 0 0 34 69 1 0 0 0 0 36 43 1 0 0 0 0 37 39 1 0 0 0 0 37 42 2 0 0 0 0 38 39 2 0 0 0 0 38 41 1 0 0 0 0 40 70 1 0 0 0 0 40 71 1 0 0 0 0 40 72 1 0 0 0 0 41 45 2 0 0 0 0 41 47 1 0 0 0 0 42 45 1 0 0 0 0 43 50 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 44 48 2 0 0 0 0 45 73 1 0 0 0 0 48 74 1 0 0 0 0 49 51 1 0 0 0 0 49 76 1 0 0 0 0 49 77 1 0 0 0 0 50 52 2 0 0 0 0 51 78 1 0 0 0 0 51 79 1 0 0 0 0 52 80 1 0 0 0 0 54 81 1 0 0 0 0 54 82 1 0 0 0 0 54 83 1 0 0 0 0 M END $$$$