B94HTR -OEChem-04042102523D 68 71 0 0 0 0 0 0 0999 V2000 2.7266 3.5928 -1.8784 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9169 -2.6750 -0.6135 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1999 -4.3114 -0.3587 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2679 3.1472 -0.1066 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3003 -2.0756 0.9393 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7369 -0.1011 -0.1677 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -3.6445 0.1457 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0607 -5.0662 0.3047 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5222 -2.6284 0.3299 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 2.7873 0.5835 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1444 -5.3023 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7084 -2.9454 -0.5832 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0871 3.5630 -0.6764 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4465 1.7534 0.9778 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7475 -3.3826 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3021 4.1741 -0.4968 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9227 2.4160 1.1194 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8876 2.1519 0.4183 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3648 -4.5811 -1.2013 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4225 2.9588 -0.8692 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9406 2.5375 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 1.1821 -0.5632 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3623 1.9095 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3581 -1.8207 0.0694 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 -0.4149 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9412 0.5812 -0.3895 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 1.9532 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3494 0.5978 -0.7151 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 -0.0827 0.3355 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6762 2.2415 -0.1249 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4025 0.9835 0.1144 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5691 1.2455 0.2703 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1251 -1.1294 0.7619 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6906 0.3850 -0.0413 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9971 -3.5395 -0.8776 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2334 -5.2405 1.3481 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8431 -5.7975 0.0689 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -1.6145 0.1044 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -2.6241 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5805 3.5168 1.4043 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8224 -5.2758 -1.6574 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5284 -6.3107 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5064 -2.2249 -0.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4154 -2.8012 -1.6316 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0659 2.8969 -1.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 4.3558 -0.9008 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7192 1.2682 1.9229 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3796 0.9615 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5393 -4.1297 1.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3941 -3.4414 2.1645 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2901 4.9349 0.2925 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6115 4.6675 -1.4236 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6732 1.6867 1.4205 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8903 3.1585 1.9271 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7632 -5.5814 -0.9983 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1282 -4.5138 -2.2693 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 -3.8723 -0.9813 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9055 -1.3081 1.4757 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7975 3.2914 2.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2863 0.8649 -1.2193 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9246 0.3154 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 2.2641 1.7503 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4927 -0.1581 -1.4837 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0157 3.2731 -0.1696 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5895 1.5212 0.5231 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0362 -0.6845 1.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4192 -1.7481 -0.0919 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7014 -1.7661 1.5457 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 2 0 0 0 0 2 24 2 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 3 19 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 4 20 1 0 0 0 0 5 15 1 0 0 0 0 5 24 1 0 0 0 0 5 58 1 0 0 0 0 6 34 3 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 7 35 1 0 0 0 0 8 11 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 12 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 18 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 16 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 17 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 23 1 0 0 0 0 21 27 1 0 0 0 0 21 59 1 0 0 0 0 22 28 2 0 0 0 0 22 60 1 0 0 0 0 23 26 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 2 0 0 0 0 26 61 1 0 0 0 0 27 31 2 0 0 0 0 27 62 1 0 0 0 0 28 31 1 0 0 0 0 28 63 1 0 0 0 0 29 32 1 0 0 0 0 29 33 1 0 0 0 0 30 32 2 0 0 0 0 30 64 1 0 0 0 0 31 34 1 0 0 0 0 32 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 M END $$$$