B5NUM0 -OEChem-04012115222D 67 73 0 1 0 0 0 0 0999 V2000 4.4485 -1.6313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1174 0.5877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -2.5358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8949 -1.7552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8949 1.7552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 -4.7683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 4.7683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1679 1.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6679 2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 -1.1671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 1.1671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1679 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1679 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1905 -0.9609 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7822 -0.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7878 -0.1543 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7720 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5816 -1.1328 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5741 -2.0749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5628 -1.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6381 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7720 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6381 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5628 1.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6688 -1.5411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5741 2.0749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5843 -0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1376 -3.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5843 0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1836 -2.8006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 -3.8567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7689 -3.7494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1836 2.8006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1376 3.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6679 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7689 3.7494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 3.8567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6679 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1679 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 -1.5595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3715 0.1446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6522 0.5582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 0.4249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5502 -1.7520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5623 1.0392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5177 -0.9398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0504 -1.5854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 -3.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7995 -2.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5112 0.4578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1348 -4.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7995 2.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 3.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4779 -0.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9779 0.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1348 4.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5602 0.2554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2505 0.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6929 2.1306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6929 1.3335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6900 -5.2716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6900 5.2716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7879 1.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3579 3.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 19 1 0 0 0 0 17 2 1 1 0 0 0 2 52 1 0 0 0 0 3 27 1 0 0 0 0 3 58 1 0 0 0 0 4 29 2 0 0 0 0 5 31 2 0 0 0 0 6 33 1 0 0 0 0 6 64 1 0 0 0 0 7 39 1 0 0 0 0 7 65 1 0 0 0 0 8 40 1 0 0 0 0 8 66 1 0 0 0 0 9 41 1 0 0 0 0 9 67 1 0 0 0 0 14 10 1 6 0 0 0 10 16 1 0 0 0 0 10 20 1 0 0 0 0 11 21 1 0 0 0 0 11 28 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 31 1 0 0 0 0 13 37 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 17 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 18 1 0 0 0 0 16 21 2 0 0 0 0 17 19 1 0 0 0 0 17 45 1 0 0 0 0 18 22 1 0 0 0 0 18 23 2 0 0 0 0 19 27 1 6 0 0 0 19 46 1 0 0 0 0 20 22 2 0 0 0 0 20 30 1 0 0 0 0 21 24 1 0 0 0 0 22 32 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 31 1 0 0 0 0 26 28 2 0 0 0 0 26 35 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 36 1 0 0 0 0 30 33 2 0 0 0 0 30 50 1 0 0 0 0 32 34 2 0 0 0 0 32 51 1 0 0 0 0 33 34 1 0 0 0 0 34 53 1 0 0 0 0 35 38 2 0 0 0 0 35 54 1 0 0 0 0 36 39 2 0 0 0 0 36 55 1 0 0 0 0 37 40 1 0 0 0 0 37 41 1 0 0 0 0 37 57 1 0 0 0 0 38 39 1 0 0 0 0 38 59 1 0 0 0 0 40 60 1 0 0 0 0 40 61 1 0 0 0 0 41 62 1 0 0 0 0 41 63 1 0 0 0 0 M END $$$$