B1BX8V -OEChem-04022104033D 67 70 0 1 0 0 0 0 0999 V2000 2.8955 -2.9478 -0.6542 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0912 3.0974 0.5373 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2379 -1.2457 0.7797 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0848 0.9738 0.4573 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4881 0.8208 0.4408 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4242 3.0964 0.7791 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8515 2.9336 0.1216 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0531 2.3400 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4603 1.6356 1.2612 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8811 1.4733 0.6057 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0877 0.8814 -1.0525 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8198 3.7197 0.9474 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0303 3.1292 -0.7069 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4456 2.9671 -1.3612 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5214 -0.6318 0.9231 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0212 -2.3738 -0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6243 -2.8750 -0.0756 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -4.1657 0.3434 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3715 -2.0320 -0.5687 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6906 -2.4794 -0.6427 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0182 -4.6132 0.2692 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3476 -5.0895 0.8754 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0139 -3.7700 -0.2238 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7557 -1.5777 -1.1695 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4102 -0.7394 -0.0602 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4692 0.2086 -0.6206 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0897 1.8894 -0.0643 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.0791 2.2384 1.0481 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4164 3.1366 -0.6378 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6936 3.6622 1.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8431 3.3834 0.2437 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 2.3689 -2.5988 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7154 1.6055 2.3284 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4499 1.2208 1.1653 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 0.9120 0.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1933 1.4401 1.6575 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0993 0.4352 -1.2165 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7983 0.3058 -1.6597 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1064 3.7166 2.0062 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8028 4.7681 0.6253 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0289 2.7013 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9817 4.1671 -1.0585 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4398 4.0022 -1.7244 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1826 2.4224 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7802 -0.6789 1.9872 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2807 -1.2034 0.3779 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4638 -0.8867 1.3307 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1221 -1.0258 -0.8983 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2869 -5.6161 0.5904 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0014 -5.4320 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9489 -4.5976 1.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9037 -5.9768 1.3404 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0382 -4.1297 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3313 -0.9147 -1.9348 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5211 -2.1707 -1.6869 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8642 -1.4086 0.6826 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6405 -0.1603 0.4672 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9867 0.8684 -1.3491 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2291 -0.3783 -1.1513 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5133 0.3224 1.1149 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6705 1.4188 -0.8694 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5668 1.3373 1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5800 2.7508 1.8783 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8139 3.6481 0.1216 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1618 3.8510 -1.0039 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7643 2.9027 -1.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6962 3.2940 1.2727 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 28 1 0 0 0 0 2 67 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 3 47 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 60 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 15 1 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 30 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 7 14 1 0 0 0 0 7 31 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 21 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 21 23 2 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 61 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 29 66 1 0 0 0 0 M END $$$$