BY37MT -OEChem-04012115343D 79 83 0 1 0 0 0 0 0999 V2000 -4.8852 1.5729 -1.0826 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6487 -0.7431 1.1213 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5357 2.4430 -0.7889 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7987 1.6999 0.0384 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3158 1.7911 -2.4515 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8732 -8.0790 -0.2805 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6503 7.6703 0.9953 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5454 0.5990 -0.3657 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4908 1.9711 -0.7217 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0153 0.0043 0.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9951 -1.4744 0.5886 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1287 -0.0213 -0.9944 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4903 -0.2594 0.3831 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9227 -1.8839 0.2661 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1721 -1.1588 -1.0644 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6682 -1.5260 0.3507 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5592 -2.5334 0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -1.5128 0.4121 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3793 -3.9775 0.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4969 -0.4206 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5213 -2.5923 0.9704 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9076 -4.8393 1.0687 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6806 -4.4940 -0.9837 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5642 3.7429 -0.3453 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8967 -0.4078 -0.0296 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8722 -2.5796 1.0289 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7374 -6.2176 0.9385 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5102 -5.8722 -1.1139 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5812 -1.4872 0.5289 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0388 -6.7340 -0.1528 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5313 4.2290 0.4563 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6260 4.5766 -0.6965 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5602 5.5488 0.9067 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6549 5.8963 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -0.4730 0.1442 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 6.3825 0.5556 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3054 -0.8606 0.3995 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3164 0.1888 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7627 -0.2389 0.2064 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7537 0.8168 -0.2896 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2007 0.3761 -0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2161 1.3981 -0.5587 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7654 8.4673 0.5986 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6453 1.0117 -0.2651 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4046 -0.0774 -1.8148 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0468 0.5895 0.9068 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7484 -2.4835 0.6531 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0162 -1.8125 -1.9291 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1969 -0.7744 -1.1042 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0044 0.4295 -0.5369 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 -3.4449 1.3998 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 -4.4535 1.9272 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2663 -3.8378 -1.7455 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3746 0.4701 -0.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3934 -3.4238 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1533 -6.8784 1.6943 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -6.2686 -1.9667 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7023 3.5833 0.7329 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4379 4.2400 -1.3332 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -2.3018 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7528 5.9218 1.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5067 6.4904 -0.5591 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3021 -8.5219 0.4717 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4247 -1.0377 1.4755 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4984 -1.8083 -0.1181 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1147 1.1389 0.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1815 0.3757 -1.1338 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9045 -0.4029 1.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9599 -1.1935 -0.2962 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5684 1.7679 0.2238 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6003 0.9912 -1.3614 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3802 -0.5887 -0.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3560 0.2120 1.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0263 2.3677 -0.0841 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1090 1.5088 -1.6436 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7989 8.6000 -0.4882 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6252 9.4606 1.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7054 8.0714 0.9977 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4282 1.7524 -0.5327 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 12 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 24 1 0 0 0 0 6 30 1 0 0 0 0 6 63 1 0 0 0 0 7 36 1 0 0 0 0 7 43 1 0 0 0 0 8 35 2 0 0 0 0 9 44 1 0 0 0 0 9 79 1 0 0 0 0 10 44 2 0 0 0 0 11 29 1 0 0 0 0 11 35 1 0 0 0 0 11 60 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 45 1 0 0 0 0 13 16 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 25 1 0 0 0 0 20 50 1 0 0 0 0 21 26 2 0 0 0 0 21 51 1 0 0 0 0 22 27 1 0 0 0 0 22 52 1 0 0 0 0 23 28 2 0 0 0 0 23 53 1 0 0 0 0 24 31 2 0 0 0 0 24 32 1 0 0 0 0 25 29 2 0 0 0 0 25 54 1 0 0 0 0 26 29 1 0 0 0 0 26 55 1 0 0 0 0 27 30 2 0 0 0 0 27 56 1 0 0 0 0 28 30 1 0 0 0 0 28 57 1 0 0 0 0 31 33 1 0 0 0 0 31 58 1 0 0 0 0 32 34 2 0 0 0 0 32 59 1 0 0 0 0 33 36 2 0 0 0 0 33 61 1 0 0 0 0 34 36 1 0 0 0 0 34 62 1 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 38 39 1 0 0 0 0 38 66 1 0 0 0 0 38 67 1 0 0 0 0 39 40 1 0 0 0 0 39 68 1 0 0 0 0 39 69 1 0 0 0 0 40 41 1 0 0 0 0 40 70 1 0 0 0 0 40 71 1 0 0 0 0 41 42 1 0 0 0 0 41 72 1 0 0 0 0 41 73 1 0 0 0 0 42 44 1 0 0 0 0 42 74 1 0 0 0 0 42 75 1 0 0 0 0 43 76 1 0 0 0 0 43 77 1 0 0 0 0 43 78 1 0 0 0 0 M END $$$$