D01VKI -OEChem-10191522352D 173176 0 1 0 0 0 0 0999 V2000 24.4200 -0.7424 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7212 0.2036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9655 0.7576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4296 1.7576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 1.5929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5133 -0.7746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1249 -0.0544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4296 0.7576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2957 2.2576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9385 -4.0180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6496 -6.7576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1617 1.7576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7598 -0.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.8219 0.7576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3578 1.7576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9559 -2.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0277 -3.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 1.8508 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8316 2.2576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8191 -0.4145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5636 3.2576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0975 -2.7309 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1617 3.7576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5282 -5.3727 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5636 -0.7424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8937 1.7576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8316 6.2576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.2239 0.2576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.9559 -0.7424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6258 0.7576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.6880 -2.7424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0995 2.2576 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9950 3.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0168 3.4600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5168 2.5940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9781 0.8727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9655 1.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 0.5637 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6976 1.7576 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2839 1.2328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6976 0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5636 2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5622 -1.0836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3328 0.9238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3543 -2.0618 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4296 3.7576 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4296 4.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5636 0.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5636 5.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6327 -4.3782 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4033 -2.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2957 3.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8896 -3.7090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6108 -4.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6976 4.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1108 -5.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0277 3.2576 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4417 -5.7794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8937 3.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8316 5.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0277 2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8937 0.7576 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.8937 4.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0899 1.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0899 0.7576 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 20.9559 2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0277 0.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7598 0.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9559 0.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9559 3.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8219 1.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0277 5.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7598 5.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0277 -0.7424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8219 -1.2424 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 17.4918 0.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3578 0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6880 -0.7424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0277 6.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7598 6.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8937 6.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1617 -1.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8937 -1.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8219 -2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5540 -1.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1617 -2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8937 -2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0277 -2.7424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2860 -1.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 1.4087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6150 3.2521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0598 3.8687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2084 4.0497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4504 3.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0152 2.9584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 2.1332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6587 -0.0051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8316 2.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9615 1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7724 1.6145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9928 1.7802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2294 -0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0870 0.8652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4855 0.1750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1776 -2.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6935 4.1826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0267 3.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0402 4.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6417 5.3402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6871 -2.5393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9621 5.7325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1651 5.7325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8392 -4.6828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2117 -1.7811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8136 -2.5624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5949 -2.9604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1773 -3.9181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4193 -3.5806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2991 4.2826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0961 4.2826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5257 -5.4970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6124 -4.6718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1617 4.3776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0277 4.1076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9912 -5.6827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1006 -1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0267 -1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1058 3.1750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5043 3.8652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2210 5.3652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6195 4.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1576 1.1826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4307 2.0676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8778 2.3402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4793 1.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3538 1.1826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9559 1.6376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8157 0.8402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4171 0.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2946 6.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3685 6.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2239 -0.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5119 1.2206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3589 1.4476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.1319 2.2945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5759 3.2576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9559 3.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3359 3.2576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4908 4.9476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2967 4.9476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8219 -0.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0933 -0.2174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8903 -0.2174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4190 -1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6258 1.3776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0865 -0.2675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.2894 -0.2675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4908 6.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2967 6.5676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8937 7.3776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6248 -0.9324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4307 -0.9324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1555 -1.7174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.9525 -1.7174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6248 -2.5524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4307 -2.5524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.6880 -3.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2249 -2.4324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.9760 -1.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.8230 -1.5524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.5960 -0.7055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4908 -4.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 85 1 0 0 0 0 1 89 1 0 0 0 0 2 36 2 0 0 0 0 3 37 2 0 0 0 0 4 42 2 0 0 0 0 5 44 1 0 0 0 0 5125 1 0 0 0 0 6 43 2 0 0 0 0 7 44 2 0 0 0 0 8 48 2 0 0 0 0 9 52 2 0 0 0 0 10 53 2 0 0 0 0 11 58 2 0 0 0 0 12 61 2 0 0 0 0 13 68 2 0 0 0 0 14 69 2 0 0 0 0 15 77 2 0 0 0 0 16 84 2 0 0 0 0 17 88 1 0 0 0 0 17173 1 0 0 0 0 18 32 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 39 1 0 0 0 0 19 98 1 0 0 0 0 20 38 1 0 0 0 0 20 43 1 0 0 0 0 20102 1 0 0 0 0 21 42 1 0 0 0 0 21 46 1 0 0 0 0 21107 1 0 0 0 0 22 45 1 0 0 0 0 22 53 1 0 0 0 0 22110 1 0 0 0 0 23 52 1 0 0 0 0 23 57 1 0 0 0 0 23123 1 0 0 0 0 24 50 1 0 0 0 0 24 58 1 0 0 0 0 24126 1 0 0 0 0 25 48 1 0 0 0 0 25127 1 0 0 0 0 25128 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26134 1 0 0 0 0 27 60 1 0 0 0 0 27141 1 0 0 0 0 27142 1 0 0 0 0 28 65 1 0 0 0 0 28 77 1 0 0 0 0 28143 1 0 0 0 0 29 69 1 0 0 0 0 29 75 1 0 0 0 0 29155 1 0 0 0 0 30 68 1 0 0 0 0 30 76 1 0 0 0 0 30156 1 0 0 0 0 31 84 1 0 0 0 0 31168 1 0 0 0 0 31169 1 0 0 0 0 32 33 1 0 0 0 0 32 37 1 0 0 0 0 32 90 1 0 0 0 0 33 34 1 0 0 0 0 33 91 1 0 0 0 0 33 92 1 0 0 0 0 34 35 1 0 0 0 0 34 93 1 0 0 0 0 34 94 1 0 0 0 0 35 95 1 0 0 0 0 35 96 1 0 0 0 0 36 38 1 0 0 0 0 38 40 1 0 0 0 0 38 97 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 39 99 1 0 0 0 0 40 44 1 0 0 0 0 40100 1 0 0 0 0 40101 1 0 0 0 0 41 48 1 0 0 0 0 41103 1 0 0 0 0 41104 1 0 0 0 0 43 45 1 0 0 0 0 45 51 1 0 0 0 0 45105 1 0 0 0 0 46 47 1 0 0 0 0 46 52 1 0 0 0 0 46106 1 0 0 0 0 47 49 1 0 0 0 0 47108 1 0 0 0 0 47109 1 0 0 0 0 49 55 1 0 0 0 0 49111 1 0 0 0 0 49112 1 0 0 0 0 50 53 1 0 0 0 0 50 54 1 0 0 0 0 50113 1 0 0 0 0 51114 1 0 0 0 0 51115 1 0 0 0 0 51116 1 0 0 0 0 54 56 1 0 0 0 0 54117 1 0 0 0 0 54118 1 0 0 0 0 55 60 1 0 0 0 0 55119 1 0 0 0 0 55120 1 0 0 0 0 56 58 1 0 0 0 0 56121 1 0 0 0 0 56122 1 0 0 0 0 57 59 1 0 0 0 0 57 61 1 0 0 0 0 57124 1 0 0 0 0 59 63 1 0 0 0 0 59129 1 0 0 0 0 59130 1 0 0 0 0 60131 1 0 0 0 0 60132 1 0 0 0 0 62 67 1 0 0 0 0 62 68 1 0 0 0 0 62133 1 0 0 0 0 63 72 2 0 0 0 0 63 73 1 0 0 0 0 64 65 1 0 0 0 0 64 66 1 0 0 0 0 64135 1 0 0 0 0 64136 1 0 0 0 0 65 69 1 0 0 0 0 65137 1 0 0 0 0 66 70 1 0 0 0 0 66 71 1 0 0 0 0 66138 1 0 0 0 0 67 74 1 0 0 0 0 67139 1 0 0 0 0 67140 1 0 0 0 0 70147 1 0 0 0 0 70148 1 0 0 0 0 70149 1 0 0 0 0 71144 1 0 0 0 0 71145 1 0 0 0 0 71146 1 0 0 0 0 72 79 1 0 0 0 0 72150 1 0 0 0 0 73 80 2 0 0 0 0 73151 1 0 0 0 0 74 82 2 0 0 0 0 74 83 1 0 0 0 0 75 78 1 0 0 0 0 75 84 1 0 0 0 0 75152 1 0 0 0 0 76 77 1 0 0 0 0 76153 1 0 0 0 0 76154 1 0 0 0 0 78 85 1 0 0 0 0 78157 1 0 0 0 0 78158 1 0 0 0 0 79 81 2 0 0 0 0 79159 1 0 0 0 0 80 81 1 0 0 0 0 80160 1 0 0 0 0 81161 1 0 0 0 0 82 86 1 0 0 0 0 82162 1 0 0 0 0 83 87 2 0 0 0 0 83163 1 0 0 0 0 85164 1 0 0 0 0 85165 1 0 0 0 0 86 88 2 0 0 0 0 86166 1 0 0 0 0 87 88 1 0 0 0 0 87167 1 0 0 0 0 89170 1 0 0 0 0 89171 1 0 0 0 0 89172 1 0 0 0 0 M END $$$$