LB78HU -OEChem-05032300083D 57 61 0 0 0 0 0 0 0999 V2000 -3.1246 -2.5845 0.2975 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1495 1.8270 -2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7718 -0.9644 1.3048 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1827 1.0227 0.4292 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9177 -0.7725 -0.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0217 1.2620 0.6437 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1594 2.1472 0.9315 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1864 2.7566 0.6545 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6208 0.4331 1.7283 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6548 -1.8344 1.5722 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9402 -1.4276 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -1.8159 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0872 2.0438 0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2833 1.8807 -0.0488 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1980 0.4347 -0.6061 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 0.1272 -0.4103 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -0.4771 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5553 -1.1271 0.6408 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7309 -0.4042 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4985 -1.1106 -0.3868 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 0.7235 0.5748 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0956 -2.4884 -0.7206 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2402 -1.7831 -1.5814 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0389 -2.4722 -1.7482 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0734 0.2332 -0.7828 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0313 -0.2865 1.3735 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1103 1.1341 -1.0263 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0680 0.6144 1.1302 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1076 1.3246 -0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0981 1.5839 -3.1308 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0657 0.7944 -0.3338 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 2.2027 1.9447 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9183 2.2392 0.1643 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3296 3.2540 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7111 3.2144 1.4839 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5939 0.8456 2.0078 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0125 0.4623 2.6399 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0237 -2.8620 1.6861 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2081 -1.5778 2.5403 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3475 1.7999 1.9438 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6111 3.0242 0.8375 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2420 2.0868 0.4365 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1772 2.5912 -0.8794 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8211 -0.2448 -0.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5023 0.3911 -1.6548 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7429 -0.6202 1.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2062 1.3017 1.1892 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8283 -3.0392 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9588 -1.7813 -2.3975 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8383 -2.9971 -2.6776 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2738 0.0419 -1.4912 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0098 -0.8347 2.3118 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8443 0.7630 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9178 2.0249 -0.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2865 2.2196 -4.0021 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1053 0.5471 -3.4841 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1239 1.8782 -2.7254 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 27 1 0 0 0 0 2 30 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 13 1 0 0 0 0 4 16 1 0 0 0 0 4 21 1 0 0 0 0 5 16 2 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 12 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 17 1 0 0 0 0 12 18 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 17 25 2 0 0 0 0 17 26 1 0 0 0 0 18 20 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 23 2 0 0 0 0 21 47 1 0 0 0 0 22 24 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 26 28 2 0 0 0 0 26 52 1 0 0 0 0 27 29 2 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END $$$$