B8UJ6L -OEChem-04042104253D 48 50 0 0 0 0 0 0 0999 V2000 -6.5849 1.3269 -0.2622 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8198 -1.4782 -1.3165 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6507 -1.6353 0.8221 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3705 0.7564 0.8209 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4656 2.7702 -0.3925 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0214 -1.1467 2.2207 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.3552 -2.1697 0.3074 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5778 0.2903 0.0043 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1283 -0.4393 -1.0955 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7451 -1.3315 1.0120 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3255 1.4993 0.8164 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6775 2.0119 1.3242 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6292 1.0149 0.7488 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9664 0.0424 -0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -0.4709 -0.6397 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1951 0.0225 -0.4644 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0077 0.9953 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6759 -0.9752 -0.6237 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2355 -0.8824 -1.2076 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7284 -0.0247 0.2773 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0666 -1.0027 -0.4778 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3594 -0.3308 -0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9650 0.6629 -0.1904 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9716 -0.8591 -0.0739 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7041 -0.5640 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4013 -1.0607 0.4581 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9232 1.3929 -0.7627 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6205 0.8960 -0.7245 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2506 0.6895 -1.7817 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6599 1.2396 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8214 2.2494 0.1971 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7137 2.0121 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8830 3.0193 0.9493 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 1.0447 -0.8507 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9454 0.0372 0.6022 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5186 1.7531 1.4825 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -1.7468 -1.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4717 -0.9041 -2.2778 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -1.9116 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8094 -0.0626 0.3789 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6419 -1.7914 -0.9555 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4734 0.1595 -1.8378 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2029 -2.0203 0.9311 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0991 2.3498 -1.2459 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8353 1.5102 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2704 -0.4004 -1.7388 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6311 1.0332 -2.6122 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2665 1.0746 -1.8932 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 23 1 0 0 0 0 1 29 1 0 0 0 0 2 15 2 0 0 0 0 3 24 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 11 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 9 19 1 0 0 0 0 9 24 1 0 0 0 0 9 42 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 18 2 0 0 0 0 15 16 1 0 0 0 0 16 19 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 20 1 0 0 0 0 17 36 1 0 0 0 0 18 21 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 24 1 0 0 0 0 22 26 2 0 0 0 0 22 28 1 0 0 0 0 23 25 2 0 0 0 0 23 27 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$