D00MLN -OEChem-10101305022D 87 92 0 1 0 0 0 0 0999 V2000 4.4057 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.7352 8.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2107 10.8820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4680 11.4425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2681 10.8851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5957 4.5369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8628 3.5369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3345 6.9409 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 1.4030 8.9418 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.4680 7.4411 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2694 8.4416 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4680 8.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1358 8.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2009 7.4411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3345 8.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2009 8.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 9.9423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1358 9.9423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0615 6.5379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2694 10.4425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8628 7.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6016 8.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0023 8.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8687 8.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3345 5.9409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3345 9.9423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0023 10.4425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 8.4418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 6.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8628 6.5379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6016 9.9423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8687 9.9423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4680 10.4425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7293 6.0376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3286 6.5379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 5.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9964 6.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7293 5.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4622 5.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4622 6.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3286 4.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9964 5.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8628 4.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5679 11.6480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3340 11.9425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9968 3.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6370 7.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4605 8.1806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4130 6.8585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8115 7.5488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8115 8.3339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4129 9.0242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1909 10.5249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7924 9.8346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6679 10.9175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8709 10.9175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1896 5.9313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6016 6.9537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4334 7.9855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 7.4082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0023 7.8216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7145 5.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3345 5.3209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9545 5.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8714 10.2523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0023 11.0625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 8.9787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.1318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 7.9049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2662 6.3476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3286 7.1579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 4.7272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4595 6.3477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9252 6.3477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3286 3.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6710 11.3564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4595 4.7272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0429 12.0466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1694 12.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 11.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6440 11.4056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8710 12.2525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 12.4795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6868 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4599 2.7269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3068 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4057 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 22 1 0 0 0 0 2 24 1 0 0 0 0 3 32 1 0 0 0 0 3 44 1 0 0 0 0 4 33 1 0 0 0 0 4 45 1 0 0 0 0 5 31 1 0 0 0 0 5 76 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 43 1 0 0 0 0 7 46 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 8 25 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 10 47 1 1 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 11 48 1 1 0 0 0 12 15 1 0 0 0 0 12 22 2 0 0 0 0 13 18 1 0 0 0 0 13 23 2 0 0 0 0 14 16 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 26 2 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 20 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 20 1 0 0 0 0 18 27 2 0 0 0 0 19 29 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 30 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 61 1 0 0 0 0 24 32 2 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 33 1 0 0 0 0 26 65 1 0 0 0 0 27 32 1 0 0 0 0 27 66 1 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 29 35 2 0 0 0 0 29 36 1 0 0 0 0 30 34 2 0 0 0 0 30 37 1 0 0 0 0 31 33 2 0 0 0 0 34 38 1 0 0 0 0 34 70 1 0 0 0 0 35 40 1 0 0 0 0 35 71 1 0 0 0 0 36 41 2 0 0 0 0 36 72 1 0 0 0 0 37 42 2 0 0 0 0 37 73 1 0 0 0 0 38 43 2 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 40 74 1 0 0 0 0 41 75 1 0 0 0 0 42 43 1 0 0 0 0 42 77 1 0 0 0 0 44 78 1 0 0 0 0 44 79 1 0 0 0 0 44 80 1 0 0 0 0 45 81 1 0 0 0 0 45 82 1 0 0 0 0 45 83 1 0 0 0 0 46 84 1 0 0 0 0 46 85 1 0 0 0 0 46 86 1 0 0 0 0 M END $$$$