# opt freq=noraman b3lyp/def2tzvpp pop=npa empiricaldispersion=gd3bj scf=(maxconventionalcycles=150,xqc)

Title

-1 1
C		3.4325420	0.2336270	1.2541340
C		4.2060850	-1.0634800	1.2076450
C		5.0203850	-1.1581950	-0.0772320
C		5.9706090	0.0328310	-0.2185230
C		5.3404830	1.3311990	0.1840200
C		4.1771730	1.4364480	0.8261480
H		5.5759960	-2.0955250	-0.1037450
H		4.8599070	-1.0504210	2.0863470
H		3.5331760	-1.9083530	1.3224770
H		2.8568190	0.3751800	2.1605090
H		6.8708750	-0.1167000	0.3912850
H		6.3266350	0.1139770	-1.2487520
H		5.8831340	2.2382470	-0.0575380
H		3.7458330	2.3967530	1.0637970
H		4.3312680	-1.1784910	-0.9235120
B		1.3230790	0.0680690	0.3358860
B		0.6423310	-1.4422490	-0.2127870
B		0.5581890	1.4579640	-0.3925830
B		0.2170300	0.9979080	1.3049680
B		0.2722340	-0.7952590	1.4175970
B		0.8266630	-0.0488180	-1.3300650
B		-1.0284680	-1.4478300	0.3926460
B		-0.6855690	-0.9882030	-1.3043090
Br		1.6860720	-3.0790780	-0.4614420
B		-1.1142880	1.4393040	0.2117020
B		-0.7380660	0.7952980	-1.4151800
Br		1.5094820	3.1070630	-0.8349150
B		-1.2898790	0.0529660	1.3294150
Br		0.8037300	2.1274400	2.7927640
Br		0.9262920	-1.6847640	3.0338040
Br		2.1318150	-0.0992590	-2.7864210
B		-1.8819100	-0.0690240	-0.3506390
Br		-1.9266370	-3.1157370	0.8481520
Br		-1.1861220	-2.1274060	-2.8030400
Br		-2.1130380	3.0936870	0.4601320
Br		-1.3003100	1.7073390	-3.0419330
Br		-2.4891020	0.1126080	2.8640340
Br		-3.7855020	-0.1516390	-0.7569780
H		1.8102581	1.4202589	-2.3459617