D0OG8A -OEChem-04152110392D 89 93 0 1 0 0 0 0 0999 V2000 3.5548 14.6744 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0732 7.1648 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8827 9.4678 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2458 15.6255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3638 15.2622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8898 12.6527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1947 11.3622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 11.8974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8346 9.6680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1566 5.8677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1217 8.5090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7282 4.2033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8827 10.4678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8827 9.4678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8827 9.4678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6037 13.3654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6824 6.9957 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0561 4.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5345 2.7242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1426 13.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6037 14.3654 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5548 13.0564 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5955 14.3696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5955 13.3613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9516 13.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9516 14.4532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8638 12.1054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8164 6.4957 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4745 7.9738 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4799 8.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3169 5.6204 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1901 6.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5664 8.4851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5845 9.0729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1436 8.7170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5037 10.4112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7618 3.9464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 2.9811 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2066 2.2725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 1.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1731 2.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6514 0.5985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8787 1.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6179 0.8554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8827 8.4678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8827 6.4678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0166 7.9678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7487 7.9678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0166 6.9678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7487 6.9678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8827 5.4678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4725 15.2052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1164 12.6180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5972 14.9896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9755 14.3704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5872 12.7761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4532 12.9132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 13.7792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 13.9516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4532 14.8176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5872 14.9548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1547 5.9621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0733 7.8133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8084 5.2425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8186 9.0515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.7372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3142 7.9187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2011 9.0081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6493 9.6895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9679 9.1377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4569 4.4958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8854 9.9226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0511 10.7022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0634 3.4204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3728 2.1257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 3.1635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3466 1.1479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3348 3.1279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4898 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4779 1.9800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0554 0.4161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4797 8.2778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2856 8.2778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4797 6.6578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2856 6.6578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2627 5.4678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8827 4.8477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5027 5.4678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4196 10.7778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 28 1 0 0 0 0 2 30 1 0 0 0 0 3 13 1 0 0 0 0 3 14 2 0 0 0 0 3 15 2 0 0 0 0 3 45 1 0 0 0 0 6 24 2 0 0 0 0 7 27 1 0 0 0 0 7 36 1 0 0 0 0 8 27 2 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 32 2 0 0 0 0 11 35 2 0 0 0 0 12 37 2 0 0 0 0 13 89 1 0 0 0 0 16 21 1 0 0 0 0 16 22 1 0 0 0 0 16 24 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 17 32 1 0 0 0 0 31 18 1 1 0 0 0 18 37 1 0 0 0 0 18 71 1 0 0 0 0 38 19 1 1 0 0 0 19 75 1 0 0 0 0 19 76 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 20 26 1 0 0 0 0 21 23 1 0 0 0 0 21 52 1 6 0 0 0 22 27 1 6 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 28 31 1 0 0 0 0 28 62 1 6 0 0 0 29 30 1 0 0 0 0 29 35 1 6 0 0 0 29 63 1 0 0 0 0 30 33 1 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 31 64 1 0 0 0 0 33 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 34 70 1 0 0 0 0 36 72 1 0 0 0 0 36 73 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 74 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 40 42 1 0 0 0 0 40 77 1 0 0 0 0 41 43 2 0 0 0 0 41 78 1 0 0 0 0 42 44 2 0 0 0 0 42 79 1 0 0 0 0 43 44 1 0 0 0 0 43 80 1 0 0 0 0 44 81 1 0 0 0 0 45 47 2 0 0 0 0 45 48 1 0 0 0 0 46 49 2 0 0 0 0 46 50 1 0 0 0 0 46 51 1 0 0 0 0 47 49 1 0 0 0 0 47 82 1 0 0 0 0 48 50 2 0 0 0 0 48 83 1 0 0 0 0 49 84 1 0 0 0 0 50 85 1 0 0 0 0 51 86 1 0 0 0 0 51 87 1 0 0 0 0 51 88 1 0 0 0 0 M END $$$$