# opt freq=noraman b3lyp/def2tzvpp pop=npa empiricaldispersion=gd3bj scf=(maxconventionalcycles=150,xqc) Title -2 1 B -0.7886880 -0.3449170 -1.1309460 B -1.2354440 -0.0385730 0.5716650 B 0.1254380 -0.6145840 1.5771660 B 1.9999050 0.0472760 -0.5073400 B 0.6530950 0.6282100 -1.5232950 B 1.1214940 1.5329650 -0.0620180 B -0.0277050 1.1155620 1.2240660 B -0.3374460 -1.5185290 0.1201480 B 0.8191380 -1.1119100 -1.1709970 B 1.3853490 -1.2818820 0.5116220 B 1.5741920 0.3516240 1.1965200 B -0.6023700 1.2845930 -0.4449500 I -2.3030750 -0.7832220 -2.6400790 I -0.2730540 -1.4067630 3.5717370 I 4.0646620 0.1017530 -1.1978030 I 0.9830460 1.4344290 -3.5186170 I 2.0484040 3.4997470 -0.1789570 I -0.5903140 2.5495170 2.7747890 I -1.2582840 -3.4962370 0.2423890 I 1.3699560 -2.5457800 -2.7150350 I 2.6577430 -2.9350780 1.1367190 I 3.0840450 0.7950900 2.7018200 I -1.9320690 2.9109370 -1.0269740 C -2.7676894 -0.0012238 1.1826717 H -3.0436007 -0.9805785 1.5137871 H -2.8059873 0.6783697 2.0082539 C -3.7455580 0.4650674 0.0881648 H -3.1964305 0.7322612 -0.7904514 C -4.5347637 1.6877710 0.5919011 H -4.8548148 2.2746289 -0.2436018 H -3.9081808 2.2805832 1.2250422