D0ZI5Z -OEChem-10101305022D 97102 0 1 0 0 0 0 0999 V2000 10.3863 3.1028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8213 1.4464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1413 -0.4945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 3.2304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8373 -0.2574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1340 -2.5053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7629 0.6114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0624 3.1616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4997 1.7759 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7939 1.4752 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0429 2.8832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8470 -0.1937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 2.4993 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7263 -0.8777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0921 3.4035 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.0223 4.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9495 4.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5923 4.0096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3260 2.7607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4370 2.2344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4272 2.0952 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7336 1.1331 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7939 1.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8018 1.1681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9073 0.1484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7921 1.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2103 2.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2103 0.6704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0207 -1.1784 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3981 2.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 1.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 0.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4078 1.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1667 0.1017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2546 -1.8213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9603 -1.5205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 2.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 0.4405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3980 1.6777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1570 -0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4283 -2.8061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7726 0.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6622 -3.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3680 -3.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 3.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8359 -4.4337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5416 -4.1329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7756 -4.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2315 2.7994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8514 4.9971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4117 4.2934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4635 5.1224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6584 5.3231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0808 3.6279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0230 4.4556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1950 2.6701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6260 1.7437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0823 1.5639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2194 1.9261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6863 0.8646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1954 1.0392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8235 0.5484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6569 2.7970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8106 3.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3219 0.2048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4956 -0.7799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.1448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9446 -1.2843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6720 -2.0333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1755 2.3918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7850 -0.3869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 3.1298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -0.1795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7797 2.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3892 -0.6123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1963 0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0796 -3.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8429 -2.7495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3090 -1.0898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6187 -0.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 2.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 1.6947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 1.4645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4918 3.4969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 4.1193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2518 3.5017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3609 -4.8322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1242 -4.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9952 0.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8832 -5.3863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 2 0 0 0 0 2 20 2 0 0 0 0 3 25 2 0 0 0 0 4 27 2 0 0 0 0 5 28 2 0 0 0 0 6 39 2 0 0 0 0 7 46 1 0 0 0 0 7 96 1 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 8 20 1 0 0 0 0 9 19 1 0 0 0 0 9 22 1 0 0 0 0 9 64 1 0 0 0 0 10 23 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 21 11 1 1 0 0 0 11 69 1 0 0 0 0 11 70 1 0 0 0 0 12 25 1 0 0 0 0 31 12 1 6 0 0 0 12 71 1 0 0 0 0 13 45 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 14 39 1 0 0 0 0 14 86 1 0 0 0 0 14 87 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 6 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 60 1 0 0 0 0 18 61 1 0 0 0 0 20 21 1 0 0 0 0 21 24 1 0 0 0 0 21 62 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 63 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 26 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 26 36 2 0 0 0 0 26 37 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 33 1 0 0 0 0 31 38 1 0 0 0 0 31 39 1 0 0 0 0 31 72 1 0 0 0 0 32 34 2 0 0 0 0 32 73 1 0 0 0 0 33 35 2 0 0 0 0 33 74 1 0 0 0 0 34 35 1 0 0 0 0 34 40 1 0 0 0 0 35 41 1 0 0 0 0 36 42 1 0 0 0 0 36 77 1 0 0 0 0 37 43 2 0 0 0 0 37 78 1 0 0 0 0 38 44 1 0 0 0 0 38 75 1 0 0 0 0 38 76 1 0 0 0 0 40 45 2 0 0 0 0 40 79 1 0 0 0 0 41 47 2 0 0 0 0 41 80 1 0 0 0 0 42 46 2 0 0 0 0 42 81 1 0 0 0 0 43 46 1 0 0 0 0 43 82 1 0 0 0 0 44 48 2 0 0 0 0 44 49 1 0 0 0 0 45 47 1 0 0 0 0 47 83 1 0 0 0 0 48 52 1 0 0 0 0 48 84 1 0 0 0 0 49 53 2 0 0 0 0 49 85 1 0 0 0 0 50 88 1 0 0 0 0 50 89 1 0 0 0 0 50 90 1 0 0 0 0 51 91 1 0 0 0 0 51 92 1 0 0 0 0 51 93 1 0 0 0 0 52 54 2 0 0 0 0 52 94 1 0 0 0 0 53 54 1 0 0 0 0 53 95 1 0 0 0 0 54 97 1 0 0 0 0 M END $$$$