B50MIV -OEChem-04022115593D 50 52 0 1 0 0 0 0 0999 V2000 5.4560 -1.6910 0.0742 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4999 -0.0082 -0.8797 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3436 0.3037 -2.2133 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6727 4.3072 2.0197 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2898 -1.3298 1.2091 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5805 -2.8493 0.1494 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6905 4.0233 -0.2323 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3762 0.8453 0.0424 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6261 -0.8825 -1.5297 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6245 -1.8443 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3859 0.3043 -0.9548 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3113 -1.2784 0.7478 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7785 0.0399 0.3768 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2212 -0.5139 -1.9892 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0745 -3.1136 -0.2769 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7096 1.4999 -1.5757 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -1.9809 1.9346 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4932 0.9800 1.1011 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2082 -3.8211 0.9191 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4296 2.4470 -0.8453 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8856 -3.2600 2.0144 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8169 2.1900 0.4804 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7364 1.3256 0.1223 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7968 0.3759 -1.1175 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8523 2.4199 1.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6123 0.1385 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5437 -0.3204 -0.4194 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0151 3.6439 0.8842 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 -1.9511 -1.3066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2106 -1.3172 -2.3493 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2621 0.2449 -2.7798 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7082 -1.4004 -2.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5544 -3.5522 -1.1214 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4167 1.7007 -2.6003 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9661 -1.5619 2.7883 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8012 0.7953 2.1249 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -4.8184 1.0051 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6957 3.3943 -1.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9775 -3.8299 2.9353 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3772 2.9424 1.0292 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0013 1.7487 -0.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8253 0.8000 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8928 2.7511 1.2884 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5305 2.0219 2.1615 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4569 -0.3512 1.3846 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7261 0.1404 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1654 -1.0645 -1.4432 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9458 -2.1485 -2.1991 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1729 -2.8152 -1.0839 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1381 5.1072 1.8284 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 1 29 1 0 0 0 0 2 14 1 0 0 0 0 2 24 1 0 0 0 0 3 24 2 0 0 0 0 4 28 1 0 0 0 0 4 50 1 0 0 0 0 7 28 2 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 15 2 0 0 0 0 11 13 1 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 18 2 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 19 1 0 0 0 0 15 33 1 0 0 0 0 16 20 1 0 0 0 0 16 34 1 0 0 0 0 17 21 1 0 0 0 0 17 35 1 0 0 0 0 18 22 1 0 0 0 0 18 36 1 0 0 0 0 19 21 2 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 23 41 1 0 0 0 0 25 28 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 M END $$$$