LBO40H -OEChem-05032300172D 85 89 0 1 0 0 0 0 0999 V2000 4.5981 5.6470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0553 -0.4075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 7.6470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 6.1470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1373 -4.8971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 2.6124 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.2641 3.1262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 4.1678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 4.6817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3465 1.6124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2067 1.1024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1951 0.1025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 6.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 7.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 5.2810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0437 -1.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 6.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9039 -1.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7757 -1.4274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1720 -1.8974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8924 -2.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6358 -1.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0206 -3.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1604 -2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0090 -4.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5076 -1.4474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8692 -4.9172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8577 -5.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7410 -4.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5896 -5.9371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7178 -6.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6012 -4.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4498 -6.4471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3215 -5.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4382 -7.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1817 -6.4671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2984 -7.9570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1702 -7.4671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4732 2.5425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 3.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 4.0618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4732 4.7515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7517 5.1607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9534 5.1515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7372 1.7272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1277 1.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8160 0.9877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4254 1.6826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 4.4570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5858 0.2172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9763 -0.4776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.8370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 6.7030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 7.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6951 7.3230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6951 5.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 4.7441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 4.9710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1797 -0.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3826 -0.9479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6387 -1.5812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4257 -3.2335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2319 -2.4077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0289 -2.4169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6199 -3.2010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 7.9570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8114 -1.9879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0481 -1.1437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2038 -0.9070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3172 -6.2209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7481 -3.8073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7107 -7.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1416 -4.6334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3287 -5.3372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8977 -7.7508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7222 -6.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2912 -8.5770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7035 -7.7833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 19 1 0 0 0 0 2 17 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 73 1 0 0 0 0 4 23 2 0 0 0 0 5 31 2 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 15 1 0 0 0 0 12 14 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 16 2 0 0 0 0 14 17 1 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 18 2 0 0 0 0 15 55 1 0 0 0 0 16 18 1 0 0 0 0 16 56 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 63 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 22 24 2 0 0 0 0 22 26 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 30 2 0 0 0 0 26 68 1 0 0 0 0 27 29 2 0 0 0 0 27 69 1 0 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