BL82NA -OEChem-04012115433D 55 59 0 0 0 0 0 0 0999 V2000 -0.3551 0.6494 1.9646 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6809 2.0666 -2.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1523 -3.6650 0.3012 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1947 -0.5911 -2.4748 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6234 0.3742 -0.0539 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3868 0.3530 0.7872 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9377 -2.7205 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7772 -1.5067 1.1419 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0487 -1.4779 -0.2991 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7722 2.1104 -0.2494 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 0.4580 1.4365 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1977 -0.9947 -0.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4011 -0.2779 0.1139 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3242 -0.5044 0.8006 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6020 0.3944 1.0292 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7559 -1.6158 0.1295 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1311 0.6448 -1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2312 1.7712 1.0472 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0219 -0.3539 1.3643 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2472 1.6733 -1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -2.7069 0.4461 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4309 1.6739 1.3737 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1317 -1.4486 1.6825 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4445 -3.8811 -0.7851 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0398 -0.6066 0.8336 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4205 1.2174 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6647 0.9131 -0.6671 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0181 -0.2128 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0501 2.3372 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5172 1.7143 -1.4464 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8992 3.1389 0.4516 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1333 2.8274 -0.8832 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4961 -1.7536 -2.9036 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3575 -0.3814 0.8543 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1359 0.1899 2.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3186 1.0177 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5172 -0.2832 -1.8364 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4999 2.5445 1.3035 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0473 1.8182 1.7746 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5191 2.7973 -0.2857 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6814 1.5696 2.4319 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1737 2.2869 0.8603 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4603 2.1586 1.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0839 -1.0367 2.6981 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5622 -2.4520 1.7665 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -4.6694 -0.8584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7326 -3.5734 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3176 -4.2755 -0.2562 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8835 2.6027 2.2623 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7097 1.4834 -2.4911 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3762 4.0061 0.8991 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7924 3.4486 -1.4818 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7373 -1.9202 -3.9577 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8184 -2.6369 -2.3419 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4125 -1.6141 -2.8252 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 2 0 0 0 0 2 20 2 0 0 0 0 3 21 2 0 0 0 0 4 28 1 0 0 0 0 4 33 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 6 22 1 0 0 0 0 7 16 1 0 0 0 0 7 21 1 0 0 0 0 7 24 1 0 0 0 0 8 19 1 0 0 0 0 8 21 1 0 0 0 0 8 23 1 0 0 0 0 9 13 2 0 0 0 0 9 16 1 0 0 0 0 10 18 1 0 0 0 0 10 20 1 0 0 0 0 10 40 1 0 0 0 0 11 25 2 0 0 0 0 11 26 1 0 0 0 0 12 25 1 0 0 0 0 12 28 2 0 0 0 0 14 16 2 0 0 0 0 14 19 1 0 0 0 0 15 18 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 17 20 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 25 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 26 27 1 0 0 0 0 26 29 2 0 0 0 0 27 28 1 0 0 0 0 27 30 2 0 0 0 0 29 31 1 0 0 0 0 29 49 1 0 0 0 0 30 32 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 M END $$$$