BU1AK8 -OEChem-04012113122D 65 68 0 0 0 0 0 0 0999 V2000 3.7320 -5.4050 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.4050 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -2.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.3808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 -2.4397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 -0.3703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -1.9325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9904 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 2.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 1.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 1.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 2.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 1.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 0.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 1.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 3.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 4.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 4.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 3.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 -3.0596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 0.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 5.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -3.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -3.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -6.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.8681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.9419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1701 -2.4706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4003 -1.6246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5542 -1.3944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6104 0.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9880 1.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3704 0.6168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 33 1 0 0 0 0 3 16 2 0 0 0 0 4 18 1 0 0 0 0 4 53 1 0 0 0 0 5 27 1 0 0 0 0 5 35 1 0 0 0 0 6 28 1 0 0 0 0 6 36 1 0 0 0 0 7 29 1 0 0 0 0 7 37 1 0 0 0 0 8 27 2 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 15 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 16 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 18 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 17 19 2 0 0 0 0 17 21 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 22 2 0 0 0 0 20 24 1 0 0 0 0 21 23 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 26 1 0 0 0 0 24 30 2 0 0 0 0 24 31 1 0 0 0 0 25 28 2 0 0 0 0 25 51 1 0 0 0 0 26 29 2 0 0 0 0 26 52 1 0 0 0 0 28 29 1 0 0 0 0 30 33 1 0 0 0 0 30 54 1 0 0 0 0 31 32 2 0 0 0 0 31 55 1 0 0 0 0 32 34 1 0 0 0 0 33 34 2 0 0 0 0 34 56 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 37 63 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 M END $$$$