B4KU0T -OEChem-04042105373D 72 76 0 0 0 0 0 0 0999 V2000 -0.4791 -2.4307 0.0004 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6694 3.4394 1.2653 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8448 -0.1377 -2.0561 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9641 -0.4491 0.2407 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8333 -1.2306 0.1919 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5127 1.5820 -0.5097 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0408 -0.5568 0.4336 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8601 -1.6496 -0.2612 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8152 0.7654 0.4091 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2716 -1.7421 0.3218 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2286 0.5930 0.9694 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6693 -0.4013 -0.2177 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7324 -1.5322 0.1889 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3290 -0.5661 0.7538 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3505 -1.3586 -0.4254 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2308 0.5034 0.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9346 0.2768 -0.9854 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3624 1.7210 0.8649 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8223 -2.1734 0.0947 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7851 -0.9657 -0.6517 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5317 -1.6662 0.2981 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9351 -0.2814 -0.7894 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4041 -1.2252 -0.7546 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7702 1.2679 -1.5006 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1979 2.7120 0.3498 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7411 2.2914 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6894 2.2619 0.4977 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6837 -0.0958 -1.3304 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1818 0.3969 -1.1686 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5921 -2.8575 1.0332 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9638 -2.6171 1.1534 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9018 2.4854 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5094 2.6821 0.3899 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5450 2.6663 1.6924 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9355 -1.7076 1.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9069 -0.8389 1.4872 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3744 -2.6255 -0.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9264 -1.4445 -1.3379 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8741 1.1456 -0.6194 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2831 1.5224 0.9978 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2211 -2.0937 1.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8225 -2.4975 -0.2521 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7168 1.5662 0.8691 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1725 0.3610 2.0412 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2215 0.5490 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7613 -0.3553 -1.3098 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1318 -2.5057 -0.1172 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6372 -1.5767 1.2813 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7645 -1.5329 0.4639 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3584 -0.5637 1.8523 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4215 -1.3718 -1.5192 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0426 -0.3877 -0.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8394 -0.6664 -1.5168 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8357 1.9078 1.7967 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8367 -0.6967 -1.5138 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3691 1.6864 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4336 3.1887 -1.4137 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2816 3.1543 0.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8515 1.6454 0.8283 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3180 1.0917 -2.4217 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3037 3.6586 0.8717 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4372 0.5918 -2.1285 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -3.5911 1.6863 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5561 -3.1526 1.8877 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3693 3.3054 0.1259 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8842 1.7994 0.9217 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9000 1.7867 2.2427 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9583 3.2791 2.3838 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5530 3.2568 -1.2336 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8063 -1.3147 2.0133 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8892 -1.3710 0.5906 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9173 -2.8007 1.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 19 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 29 2 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 5 35 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 11 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 15 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 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 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 24 1 0 0 0 0 17 53 1 0 0 0 0 18 25 2 0 0 0 0 18 54 1 0 0 0 0 19 23 2 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 20 28 1 0 0 0 0 21 31 1 0 0 0 0 22 28 2 0 0 0 0 22 29 1 0 0 0 0 23 55 1 0 0 0 0 24 32 2 0 0 0 0 24 60 1 0 0 0 0 25 32 1 0 0 0 0 25 61 1 0 0 0 0 26 33 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 34 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 62 1 0 0 0 0 30 31 2 0 0 0 0 30 63 1 0 0 0 0 31 64 1 0 0 0 0 32 69 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 M END $$$$