LJ96HB -OEChem-05032301092D 84 86 0 1 0 0 0 0 0999 V2000 7.1962 -3.9369 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 6.4773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.4369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -5.7157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.4369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 -4.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 -3.0709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.9773 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.9369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 -6.9757 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0372 2.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 2.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 6.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 7.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.4369 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 -0.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.9369 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 -5.4369 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 -4.4369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -6.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.4369 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0981 -6.9757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 -6.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4756 1.8318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4756 2.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1846 2.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1846 1.8318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9029 1.3258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 2.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 3.5850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 3.5850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 2.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 4.3697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 5.0599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 5.0599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 4.3697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 6.7873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.2469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8162 7.4773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 8.0973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5762 7.4773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7522 5.4404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 5.6673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3722 6.5143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.8169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -0.4619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -0.4619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.6269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1505 -5.1554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -3.8543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -4.5446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9735 -6.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7171 -5.4877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.6269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -4.7469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0333 -7.5923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7045 -7.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7336 -7.4773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.6269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.4738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -2.4369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -2.4369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -5.7469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -3.7469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 2 0 0 0 0 1 10 2 0 0 0 0 1 36 1 0 0 0 0 2 18 1 0 0 0 0 2 24 1 0 0 0 0 3 23 2 0 0 0 0 4 24 2 0 0 0 0 5 33 2 0 0 0 0 36 6 1 1 0 0 0 6 83 1 0 0 0 0 7 38 2 0 0 0 0 8 84 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 24 1 0 0 0 0 28 12 1 6 0 0 0 12 55 1 0 0 0 0 30 13 1 6 0 0 0 13 33 1 0 0 0 0 13 71 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 76 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 21 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 22 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 54 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 62 1 0 0 0 0 29 35 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 32 1 0 0 0 0 30 36 1 0 0 0 0 30 65 1 0 0 0 0 31 32 1 6 0 0 0 31 34 1 0 0 0 0 31 38 1 0 0 0 0 31 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 34 37 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 35 39 1 0 0 0 0 35 40 1 0 0 0 0 35 72 1 0 0 0 0 36 73 1 0 0 0 0 37 74 1 0 0 0 0 37 75 1 0 0 0 0 39 77 1 0 0 0 0 39 78 1 0 0 0 0 39 79 1 0 0 0 0 40 80 1 0 0 0 0 40 81 1 0 0 0 0 40 82 1 0 0 0 0 M END $$$$