* Input_File: "/usr/local/apache-tomcat-5.5.15/temp/inchi22093/input.mol"
Structure: 1
InChI=1/C12H17BO4S/c1-11(2)12(3,4)17-13(16-11)10-9-8(7-18-10)14-5-6-15-9/h7H,5-6H2,1-4H3
AuxInfo=1/0/N:14,18,22,26,6,3,10,9,2,1,12,13,30,32,31,33,34,35/E:(1,2,3,4)(11,12)(16,17)/rA:35nCCCHHCHHCCHCCCHHHCHHHCHHHCHHHBOOOOS/rB:d1;;s3;s3;s3;s6;s6;s2;d9;s10;;s12;s12;s14;s14;s14;s12;s18;s18;s18;s13;s22;s22;s22;s13;s26;s26;s26;s1;s2s3;s6s9;s12s30;s13s30;s1s10;/rC:5.0079,7.6843,1.8655;6.1374,7.2533,2.4432;8.1762,7.46,3.4567;8.587,7.9455,4.1367;8.779,7.5445,2.7568;8.0209,6.0056,3.7788;8.9002,5.6377,4.0188;7.4064,5.9217,4.4705;6.425,5.8753,2.2709;5.5271,5.2556,1.5406;5.5675,4.3404,1.3151;2.6288,10.5341,1.4076;3.6437,11.1591,2.3167;1.1667,10.704,1.7451;.6026,10.2862,1.1321;.9537,11.6587,1.7993;1.0007,10.2767,2.5215;2.8674,10.9737,.1147;3.8134,10.8533,-.0878;2.6259,11.9184,.027;2.3162,10.4315,-.425;3.1245,11.1777,3.5934;2.7775,10.2913,3.8021;2.4065,11.8402,3.6627;3.8538,11.4137,4.1407;4.1677,12.5252,1.9565;4.777,12.8579,2.5765;3.4165,13.1467,1.8668;4.6478,12.4535,1.1935;4.2561,9.026,1.8711;6.8931,8.0524,3.1749;7.5007,5.2432,2.7816;2.9693,9.1128,1.4605;4.764,10.2061,2.2968;4.3155,6.3531,1.0846;