D00616 -OEChem-05072121552D 48 52 0 1 0 0 0 0 0999 V2000 3.6730 2.5947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 0.6640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8893 -1.0090 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9575 -1.5267 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9509 -2.9047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 0.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 1.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 0.1464 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9819 -0.2887 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5092 1.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -0.1564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8876 -0.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 1.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9819 0.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2163 -0.5607 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8770 -0.8525 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3310 -1.7436 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8761 -0.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6239 -2.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1822 -0.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7329 -1.9967 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8419 -2.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3444 0.5024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8478 -0.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1198 1.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7212 1.6945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -0.6539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -0.6539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5782 -1.3028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4127 -1.0951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6247 1.6945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2262 1.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6383 1.2726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3885 0.5770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5188 0.0545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8068 -0.9255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6174 -0.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8324 -0.0037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9915 -2.2786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4468 -1.1469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0155 -0.3005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2863 -2.9706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1058 -2.8408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2313 -1.6323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1361 2.9047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3959 -1.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3586 -1.6871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 46 1 0 0 0 0 2 21 2 0 0 0 0 3 17 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 16 4 1 1 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 23 3 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 7 10 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 24 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 21 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 39 1 6 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 6 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 22 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 22 23 1 1 0 0 0 22 45 1 0 0 0 0 M END $$$$