L21MBA -OEChem-05032300562D 75 79 0 1 0 0 0 0 0999 V2000 4.7518 1.3766 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5332 -2.6977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8048 -3.1859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0496 -0.5071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9283 -2.6284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8478 -2.0556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 0.1178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0321 5.9866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0185 -4.7291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8602 -3.1460 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3766 -0.9554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7934 -0.6814 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4477 5.0836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0446 5.8721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0849 -4.3708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4556 -5.1479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0002 -5.9866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9662 -5.7278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8261 -3.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8572 -4.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6014 -2.1801 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7482 -4.6385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3085 -1.4730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6354 -1.9213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5106 -0.4554 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2518 0.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6178 1.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7172 -1.0641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7518 1.3766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4838 1.3766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4838 0.3766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6017 2.9181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7300 3.4080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3938 1.8834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 3.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4018 2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7184 4.4080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6628 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8698 2.8981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8467 4.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 3.3880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9865 4.3880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5457 -3.9559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0172 -4.7095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9738 -5.5381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4478 -6.2681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2224 -6.5654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0632 -6.3401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5853 -5.6953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4218 -3.5844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2002 -2.3406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4667 -5.1909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3006 -4.9200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0297 -4.0861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6641 -1.9809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8704 -1.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5511 -1.0740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8685 -0.5779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8134 0.9490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7148 0.2006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5397 0.7940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5913 1.9755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9271 1.5672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4974 4.0658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 3.2330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6226 -0.7983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5081 -1.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3774 -1.7821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2775 0.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5819 0.9247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0481 0.2291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 2.2781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4647 3.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 4.6917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 29 1 0 0 0 0 2 19 2 0 0 0 0 3 20 2 0 0 0 0 4 23 1 0 0 0 0 4 31 1 0 0 0 0 5 24 2 0 0 0 0 6 28 2 0 0 0 0 7 31 2 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 15 1 0 0 0 0 9 18 1 0 0 0 0 9 20 1 0 0 0 0 10 19 1 0 0 0 0 21 10 1 1 0 0 0 10 51 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 11 59 1 0 0 0 0 12 28 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 37 2 0 0 0 0 14 41 2 0 0 0 0 15 16 1 0 0 0 0 15 19 1 1 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 1 0 0 0 25 58 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 27 32 2 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 31 1 0 0 0 0 30 34 2 0 0 0 0 32 33 1 0 0 0 0 32 35 1 0 0 0 0 33 37 1 0 0 0 0 33 40 2 0 0 0 0 34 36 1 0 0 0 0 34 64 1 0 0 0 0 35 36 2 0 0 0 0 35 65 1 0 0 0 0 36 66 1 0 0 0 0 37 41 1 0 0 0 0 38 67 1 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 39 70 1 0 0 0 0 39 71 1 0 0 0 0 39 72 1 0 0 0 0 40 42 1 0 0 0 0 40 73 1 0 0 0 0 41 43 1 0 0 0 0 42 43 2 0 0 0 0 42 74 1 0 0 0 0 43 75 1 0 0 0 0 M END $$$$