* Input_File: "/opt/eprints3/archives/ecrystals/documents/disk0/00/00/08/16/01/2009src0893c.mol"
Structure: 1
InChI=1/C14H15B.C7H12NO2/c1-3-5-12-15(13-6-4-2)14-10-8-7-9-11-14;1-8-4-5-10-7(8)3-2-6(8)9/h3-13H,1-2H2;7H,2-5H2,1H3/b12-5+,13-6+;/t;7-/m.0/s1
AuxInfo=1/0/N:28,35,26,33,24,31,42,40,44,38,46,23,30,37,48;16,12,9,4,1,15,7,20,22,21/E:(1,2)(3,4)(5,6)(8,9)(10,11)(12,13);/it:;im/CRV:;8.4/rA:48nCHHCHHCHCHHCHHCCHHHN4OOCCHCHCHCCHCHCHCCHCHCHCHCHB/rB:s1;s1;s1;s4;s4;;s7;s7;s9;s9;s9;s12;s12;s12;;s16;s16;s16;s4s7s15s16;s1s7;d15;;d23;s24;s24;s26;d26;s28;;d30;s31;s31;s33;d33;s35;;d37;s38;s38;s40;d40;s42;s42;s44;s37d44;s46;s23s30s37;/rC:-4.3545,-10.2949,-.839;-4.4348,-9.6307,-.1093;-5.2157,-10.7706,-.9493;-3.8923,-9.6498,-2.144;-4.1423,-10.2082,-2.9224;-4.2892,-8.7495,-2.2534;-2.0891,-10.4668,-.7499;-1.898,-9.921,.0659;-.9285,-11.3067,-1.1353;-.9439,-12.171,-.6527;-.0768,-10.8433,-.9355;-1.09,-11.5207,-2.6347;-.2173,-11.7129,-3.0609;-1.7107,-12.2691,-2.8208;-1.6517,-10.2249,-3.1267;-1.8976,-8.1682,-1.7459;-.935,-8.1846,-1.5628;-2.3707,-7.7943,-.9733;-2.0706,-7.6132,-2.5348;-2.3815,-9.5634,-2.0008;-3.2567,-11.2155,-.6104;-1.6118,-9.8294,-4.3362;.1517,-9.8515,2.4279;-.6059,-11.0348,2.4161;-.1479,-11.8668,2.3915;-1.9973,-11.042,2.439;-2.4647,-11.8691,2.4375;-2.7055,-9.8515,2.4639;-3.655,-9.8515,2.4973;2.1267,-9.8515,.7378;2.2101,-8.6929,-.0129;2.201,-7.8588,.4417;2.3069,-8.6885,-1.4047;2.3491,-7.8597,-1.8672;2.3418,-9.8515,-2.1114;2.3887,-9.8515,-3.0602;2.4443,-8.566,3.1527;3.6659,-7.9782,2.7942;4.0947,-8.2649,1.9965;4.274,-6.9897,3.5642;5.106,-6.623,3.2888;3.6752,-6.5371,4.7279;4.0868,-5.8597,5.2516;2.4668,-7.0892,5.1141;2.0399,-6.7863,5.9069;1.8765,-8.0828,4.3484;1.053,-8.4541,4.6426;1.7965,-9.8515,2.3525;