BOH0C2 -OEChem-04012114363D 78 81 0 1 0 0 0 0 0999 V2000 5.0195 1.1747 -0.7766 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3977 4.3274 0.3731 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8744 3.6436 2.1368 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3467 -2.8368 2.6648 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9497 2.5314 -0.0452 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7776 1.3341 -2.1296 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4037 -0.2362 1.0341 N 0 0 2 0 0 0 0 0 0 0 0 0 0.5360 -3.4149 0.6005 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0888 1.0621 0.9752 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0582 2.0151 0.6126 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3051 1.3993 1.2756 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8449 0.0164 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1998 1.0974 -0.0715 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0844 2.3276 0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4928 1.3611 0.3321 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1924 -1.2831 1.6722 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2034 2.3493 -0.9209 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2075 3.3912 1.1443 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1395 3.5359 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3866 -2.5711 1.7082 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6751 2.0196 0.6783 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4077 2.9980 -1.3835 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3925 0.6624 -0.8839 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3958 1.5584 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7275 1.9565 -0.2117 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4734 0.6143 -1.7677 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6293 1.2727 -1.4019 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4068 -3.0853 -0.5213 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1697 -4.6892 0.4855 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8273 -3.6056 -0.3277 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5235 -4.5447 -0.2016 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6096 2.1336 -1.2644 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7517 -3.2380 -1.4906 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -5.8726 -0.2994 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1736 -3.7171 -1.2423 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6477 -5.6875 -0.9336 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5054 1.2925 1.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1528 2.0852 -0.4788 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5895 1.9854 2.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5996 -0.7562 1.5806 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6641 0.0707 2.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7844 1.0654 -1.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 0.2093 0.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5038 3.2466 -0.0138 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5076 2.3198 1.1142 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1649 -1.4299 1.2055 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4215 -1.0207 2.7148 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7892 2.3297 -1.9369 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7663 4.4374 -1.2639 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3135 3.7701 0.2872 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7718 2.5639 1.6114 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 3.5383 -1.0797 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3371 3.0363 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4773 0.1440 -1.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8975 0.8846 -1.6152 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 1.4574 0.0673 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2363 5.2359 0.7059 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4006 0.0755 -2.7055 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4156 -2.0078 -0.7044 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9774 -3.5236 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -5.4097 -0.0428 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3257 -5.0815 1.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8038 -4.6976 -0.2211 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2506 -3.2242 0.6085 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3857 -4.1294 -1.2075 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1334 -3.8177 0.3499 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9167 3.0349 -1.8074 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5048 1.5560 -1.0065 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7596 -2.1503 -1.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3747 -3.6812 -2.4193 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6958 -6.5868 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4011 -6.3044 0.7006 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5892 -3.2606 -0.3383 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8168 -3.4466 -2.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 -4.8049 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2648 -5.0034 -0.3423 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1693 -6.6476 -0.9959 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5592 -5.2823 -1.9466 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 24 1 0 0 0 0 2 18 1 0 0 0 0 2 57 1 0 0 0 0 3 18 2 0 0 0 0 4 20 2 0 0 0 0 5 25 1 0 0 0 0 5 32 1 0 0 0 0 6 27 1 0 0 0 0 6 32 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 16 1 0 0 0 0 8 20 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 17 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 21 2 0 0 0 0 15 23 1 0 0 0 0 16 20 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 19 1 0 0 0 0 17 48 1 0 0 0 0 19 22 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 21 25 1 0 0 0 0 21 51 1 0 0 0 0 22 24 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 26 2 0 0 0 0 23 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 27 2 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 28 30 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 31 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 33 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 31 34 1 0 0 0 0 31 65 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 33 35 1 0 0 0 0 33 69 1 0 0 0 0 33 70 1 0 0 0 0 34 36 1 0 0 0 0 34 71 1 0 0 0 0 34 72 1 0 0 0 0 35 73 1 0 0 0 0 35 74 1 0 0 0 0 35 75 1 0 0 0 0 36 76 1 0 0 0 0 36 77 1 0 0 0 0 36 78 1 0 0 0 0 M END $$$$