Structures published

Total: 91

C₆₃H₅₈F₆N₆OSb

Sakamaki, Daisuke Saeki, Hidenori Seki, Shu

Materials Chemistry Frontiers (2018) 2, 3 530

a=15.927(3)Å b=13.626(2)Å c=25.437(4)Å

α=90.0000° β=106.335(2)° γ=90.0000°

C₆₃H₅₅N₆

Sakamaki, Daisuke Saeki, Hidenori Seki, Shu

Materials Chemistry Frontiers (2018) 2, 3 530

a=14.2255(16)Å b=29.980(4)Å c=22.944(3)Å

α=90.0000° β=92.5721(18)° γ=90.0000°

C_247.73H_123.18N₂

Yokoi, Hiroki Hiroto, Satoru Sakamaki, Daisuke Seki, Shu Shinokubo, Hiroshi

Chemical science (2018) 9, 4 819-824

a=13.1579(2)Å b=37.8588(7)Å c=30.9277(5)Å

α=90° β=96.192(2)° γ=90°

C₁₆₀H₉₄N₂

Yokoi, Hiroki Hiroto, Satoru Sakamaki, Daisuke Seki, Shu Shinokubo, Hiroshi

Chemical science (2018) 9, 4 819-824

a=17.0175(8)Å b=28.9186(13)Å c=22.7929(10)Å

α=90° β=100.4840(10)° γ=90°

C_112.5H₄₇ClNO₀

Hiroki Yokoi Yuya Hiraoka Satoru Hiroto Daisuke Sakamaki Shu Seki Hiroshi Shinokubo

Nature Communications (2015) 6, 8215

a=13.462(14)Å b=14.743(15)Å c=18.096(19)Å

α=98.297(17)° β=101.322(14)° γ=97.33(2)°

C₅₅H₅₈Br₃Cl₅N

Hiroki Yokoi Yuya Hiraoka Satoru Hiroto Daisuke Sakamaki Shu Seki Hiroshi Shinokubo

Nature Communications (2015) 6, 8215

a=11.6888(11)Å b=15.2279(14)Å c=16.1361(16)Å

α=94.960(3)° β=111.005(3)° γ=103.447(2)°

C₅₀H₅₁N

Hiroki Yokoi Yuya Hiraoka Satoru Hiroto Daisuke Sakamaki Shu Seki Hiroshi Shinokubo

Nature Communications (2015) 6, 8215

a=9.9215(5)Å b=11.5220(5)Å c=17.8122(9)Å

α=104.4750(10)° β=93.8730(10)° γ=108.0950(10)°

C₈₈H₂₄O₄

Umeyama, Tomokazu Miyata, Tetsushi Jakowetz, Andreas C.Shibata, Sho Kurotobi, Kei Higashino, Tomohiro Koganezawa, Tomoyuki Tsujimoto, Masahiko Gélinas, Simon Matsuda, Wakana Seki, Shu Friend, Richard H.Imahori, Hiroshi

Chemical science (2017) 8, 1 181-188

a=26.123(4)Å b=26.123(4)Å c=14.146(2)Å

α=90° β=90° γ=90°

C₈₈H₂₄O_4,0.5(C₆H₁₄)

Chemical science (2017) 8, 1 181-188

a=10.1470(16)Å b=23.719(4)Å c=21.227(4)Å

α=90° β=102.193(2)° γ=90°

C₈₂H₁₄O₂

Chemical science (2017) 8, 1 181-188

a=10.9852(7)Å b=20.5331(14)Å c=19.4487(13)Å

α=90° β=91.193(6)° γ=90°

C₁₆₆H₆₄N₁₂Ni₂

Nobukuni, Hirofumi Tani, Fumito Shimazaki, Yuichi Naruta, Yoshinori Ohkubo, Kei Nakanishi, Tatsuaki Kojima, Takahiko Fukuzumi, Shunichi Seki, Shu

The Journal of Physical Chemistry C (2009) 113, 45 19694

a=36.842(4)Å b=14.498(2)Å c=24.607(4)Å

α=90° β=115.396(5)° γ=90°

C₂₄H₁₂F₆O₂S₂

Ie, Yutaka Nitani, Masashi Uemura, Takafumi Tominari, Yukihiro Takeya, Jun Honsho, Yoshihito Saeki, Akinori Seki, Shu Aso, Yoshio

The Journal of Physical Chemistry C (2009) 113, 39 17189

a=6.844(6)Å b=22.211(19)Å c=13.877(10)Å

α=90.0000° β=90.0000° γ=90.0000°

C_21.75H₁₅B_0.5Cl₂FN

Hayashi, Yosuke Obata, Naoki Tamaru, Masatomo Yamaguchi, Shigeru Matsuo, Yutaka Saeki, Akinori Seki, Shu Kureishi, Yuka Saito, Shohei Yamaguchi, Shigehiro Shinokubo, Hiroshi

Organic letters (2012) 14, 3 866-869

a=10.2548(11)Å b=13.2868(15)Å c=14.5076(16)Å

α=112.753(2)° β=97.302(2)° γ=92.737(2)°

C₂₆H₂₄NO₂PS

Matano, Yoshihiro Ohkubo, Hiroshi Honsho, Yoshihito Saito, Arihiro Seki, Shu Imahori, Hiroshi

Organic letters (2013) 15, 4 932-935

a=11.060(3)Å b=18.268(5)Å c=21.576(6)Å

α=90.00° β=90.00° γ=90.00°

C₁₀H₇N₂Ni_0.5

Ukai, Shusaku Koo, Yun Hee Fukui, Norihito Seki, Shu Shinokubo, Hiroshi

Dalton transactions (Cambridge, England : 2003) (2020) 49, 41 14383-14387

a=19.3223(7)Å b=4.66930(10)Å c=17.6807(6)Å

α=90° β=112.336(4)° γ=90°

C₅₄H₅₆N₂

Nakazato, Takumi Kamatsuka, Takuto Inoue, Junichi Sakurai, Tsuneaki Seki, Shu Shinokubo, Hiroshi Miyake, Yoshihiro

Chemical communications (Cambridge, England) (2018) 54, 41 5177-5180

a=7.2956(4)Å b=10.3483(6)Å c=14.0315(7)Å

α=96.970(2)° β=98.026(2)° γ=100.566(2)°

C₃₄H₂₄N₂S₄

Nakazato, Takumi Kamatsuka, Takuto Inoue, Junichi Sakurai, Tsuneaki Seki, Shu Shinokubo, Hiroshi Miyake, Yoshihiro

Chemical communications (Cambridge, England) (2018) 54, 41 5177-5180

a=15.9885(7)Å b=6.2625(3)Å c=14.7453(6)Å

α=90° β=111.597(5)° γ=90°

C₃₄H₄₈N₂

Nakazato, Takumi Kamatsuka, Takuto Inoue, Junichi Sakurai, Tsuneaki Seki, Shu Shinokubo, Hiroshi Miyake, Yoshihiro

Chemical communications (Cambridge, England) (2018) 54, 41 5177-5180

a=21.6241(8)Å b=4.7229(3)Å c=27.9845(9)Å

α=90° β=90° γ=90°

C₇₅H₂₂S₂

Mikie, Tsubasa Saeki, Akinori Masuda, Hiroyuki Ikuma, Naohiko Kokubo, Ken Seki, Shu

Journal of Materials Chemistry A (2015) 3, 3 1152

a=9.97592(18)Å b=19.8174(4)Å c=20.1513(4)Å

α=90.00° β=90.00° γ=90.00°

C_16.5H₁₁N₃Ni_0.5

Yoshida, Takuya Sakamaki, Daisuke Seki, Shu Shinokubo, Hiroshi

Chemical communications (Cambridge, England) (2017) 53, 6 1112-1115

a=10.7913(16)Å b=23.085(4)Å c=9.7956(12)Å

α=90° β=98.370(14)° γ=90°

C₃₂H₂₃N₅Ni

Yoshida, Takuya Sakamaki, Daisuke Seki, Shu Shinokubo, Hiroshi

Chemical communications (Cambridge, England) (2017) 53, 6 1112-1115

a=14.9222(10)Å b=10.1071(7)Å c=16.9856(11)Å

α=90° β=111.902(2)° γ=90°

C₃₂H₁₈Cl₂F₅N₅Ni

Yoshida, Takuya Sakamaki, Daisuke Seki, Shu Shinokubo, Hiroshi

Chemical communications (Cambridge, England) (2017) 53, 6 1112-1115

a=16.003(2)Å b=10.6329(14)Å c=17.070(2)Å

α=90° β=100.125(4)° γ=90°

C₃₅H₂₉N₅Ni

Yoshida, Takuya Sakamaki, Daisuke Seki, Shu Shinokubo, Hiroshi

Chemical communications (Cambridge, England) (2017) 53, 6 1112-1115

a=11.547(4)Å b=7.327(2)Å c=32.081(9)Å

α=90° β=96.234(5)° γ=90°

C₅₁H_31.5F₉N_7.5Ni_1.5

Yoshida, Takuya Sakamaki, Daisuke Seki, Shu Shinokubo, Hiroshi

Chemical communications (Cambridge, England) (2017) 53, 6 1112-1115

a=17.128(4)Å b=11.539(2)Å c=21.492(4)Å

α=90° β=94.759(3)° γ=90°

C₄₀H₄₆N₂S₂

Daisuke Sakamaki Daisuke Kumano Eiji Yashim Shu Seki

Chem.Commun. (2015) 51, 17237

a=9.4905(3)Å b=13.4085(4)Å c=15.1433(5)Å

α=77.1900(17)° β=87.7430(19)° γ=74.9540(18)°

C₄₁H₄₈Cl₈N₂S₂Sb

Daisuke Sakamaki Daisuke Kumano Eiji Yashim Shu Seki

Chem.Commun. (2015) 51, 17237

a=11.982(4)Å b=15.925(6)Å c=24.598(9)Å

α=90.0000° β=90.150(6)° γ=90.0000°

C₄₁H₅₂N₂OS₂

Daisuke Sakamaki Daisuke Kumano Eiji Yashim Shu Seki

Chem.Commun. (2015) 51, 17237

a=23.0126(5)Å b=29.0068(6)Å c=22.0641(4)Å

α=90.0000° β=104.7159(7)° γ=90.0000°

C₄₆H₆₂Cl₁₂N₂S₂Sb₂

Daisuke Sakamaki Daisuke Kumano Eiji Yashim Shu Seki

Chem.Commun. (2015) 51, 17237

a=16.3370(12)Å b=20.1317(13)Å c=20.3767(14)Å

α=103.1816(19)° β=91.496(2)° γ=112.2261(18)°

C₅₀H₃₈BCl₂N₅O₂Pt

Ryo Sekiya Yusuke Tsutsui Wookjin Choi Tsuneaki Sakurai Shu Seki Yuya Bandoa Hiromitsu Maeda

Chem.Commun. (2014) 50, 10615

a=12.2811(2)Å b=12.5617(2)Å c=26.9413(5)Å

α=90.00° β=100.9434(7)° γ=90.00°

C₃₀H₃₁BF₂N₂O₈

Maeda, Hiromitsu Terashima, Yoshitaka Haketa, Yohei Asano, Atsushi Honsho, Yoshihito Seki, Shu Shimizu, Masahiro Mukai, Hidetomo Ohta, Kazuchika

Chemical Communications (2010) 46, 25 4559-4561

a=12.997(2)Å b=13.014(3)Å c=33.825(8)Å

α=90.00° β=96.658(8)° γ=90.00°

C₃₁H₃₃BF₂N₂O₈

Maeda, Hiromitsu Terashima, Yoshitaka Haketa, Yohei Asano, Atsushi Honsho, Yoshihito Seki, Shu Shimizu, Masahiro Mukai, Hidetomo Ohta, Kazuchika

Chemical Communications (2010) 46, 25 4559-4561

a=29.464(14)Å b=7.038(4)Å c=13.928(10)Å

α=90.00° β=102.28(2)° γ=90.00°

5

C_15.5H₉ClS₂

Shohei Kato Yuma Serizawa Daisuke Sakamaki Shu Seki Yoshihiro Miyake Hiroshi Shinokubo

Chem.Commun. (2015) 51, 16944

a=25.926(9)Å b=10.268(4)Å c=9.738(3)Å

α=90.00° β=90.00° γ=90.00°

1d

C₄₀H₄₀S₄

Shohei Kato Yuma Serizawa Daisuke Sakamaki Shu Seki Yoshihiro Miyake Hiroshi Shinokubo

Chem.Commun. (2015) 51, 16944

a=4.7699(19)Å b=13.122(5)Å c=14.121(5)Å

α=68.200(14)° β=74.332(19)° γ=85.09(2)°

C₄₇H₆₇B₄O₈S₄

Shohei Kato Yuma Serizawa Daisuke Sakamaki Shu Seki Yoshihiro Miyake Hiroshi Shinokubo

Chem.Commun. (2015) 51, 16944

a=12.2323(6)Å b=13.9489(7)Å c=16.2345(8)Å

α=76.272(2)° β=81.959(2)° γ=78.768(2)°

1b

C₁₄₀H_170.52Cl_9.78S₄

Shohei Kato Yuma Serizawa Daisuke Sakamaki Shu Seki Yoshihiro Miyake Hiroshi Shinokubo

Chem.Commun. (2015) 51, 16944

a=42.616(7)Å b=17.397(3)Å c=18.769(3)Å

α=90° β=98.476(3)° γ=90°

C₅₁H₄₈N₂O₂S₂

Padalkar, Vikas S.Sakamaki, Daisuke Tohnai, Norimitsu Akutagawa, Tomoyuki Sakai, Ken-ichi Seki, Shu

RSC Adv. (2015)

a=11.7603(2)Å b=14.1138(3)Å c=14.5223(3)Å

α=65.8221(8)° β=86.8240(9)° γ=70.2805(8)°

C₁₂H₁₈F₁₂MgN₂O₁₂S₄

Tsuzuki, Seiji MANDAI, Toshihiko Suzuki, Soma Shinoda, Wataru Nakamura, Takenobu Morishita, Tetsuya Ueno, Kazuhide Seki, Shiro Umebayashi, Yasuhiro Dokko, Kaoru Watanabe, Masayoshi

Phys. Chem. Chem. Phys. (2017)

a=8.7021(4)Å b=9.1183(6)Å c=9.2356(5)Å

α=97.006(5)° β=95.727(4)° γ=100.012(5)°

C₂₁H₃₃Br₄Cl₃Cu₆N₄S₈

Okubo, Takashi Tanaka, Naoya Kim, Kyung Ho Anma, Haruho Seki, Shu Saeki, Akinori Maekawa, Masahiko Kuroda-Sowa, Takayoshi

Dalton transactions (Cambridge, England : 2003) (2011) 40, 10 2218-2224

a=15.6452(5)Å b=15.6452(5)Å c=15.9953(6)Å

α=90.0000° β=90.0000° γ=90.0000°

C₃₁H₄₂CuN₃O₄

Takaichi, June Ohkubo, Kei Sugimoto, Hideki Nakano, Motohiro Usa, Daisuke Maekawa, Hiroaki Fujieda, Nobutaka Nishiwaki, Nagatoshi Seki, Shu Fukuzumi, Shunichi Itoh, Shinobu

Dalton transactions (Cambridge, England : 2003) (2013) 42, 7 2438-2444

a=13.6036(4)Å b=11.5230(4)Å c=19.6796(6)Å

α=90.0000° β=106.8925(8)° γ=90.0000°

C_40.50H₆₃ClCuN₄O₄

Takaichi, June Ohkubo, Kei Sugimoto, Hideki Nakano, Motohiro Usa, Daisuke Maekawa, Hiroaki Fujieda, Nobutaka Nishiwaki, Nagatoshi Seki, Shu Fukuzumi, Shunichi Itoh, Shinobu

Dalton transactions (Cambridge, England : 2003) (2013) 42, 7 2438-2444

a=40.5296(17)Å b=9.2215(4)Å c=24.1373(9)Å

α=90.0000° β=112.2690(14)° γ=90.0000°

C₁₆H₂₈Br₃Cu₄N₂S₄

Takashi Okubo Haruho Anma Naoya Tanaka Kento Himoto Shu Seki Akinori Saeki Masahiko Maekawa Takayoshi Kuroda-Sowa

Chem.Commun. (2013) 49, 4316

a=7.823(4)Å b=9.518(5)Å c=33.157(16)Å

α=90.0000° β=98.469(7)° γ=90.0000°

C₁₂H₁₇N₃O₆

Miyashita, Kazuyuki Rahman, S M Abdur Seki, Sayori Obika, Satoshi Imanishi, Takeshi

Chemical communications (Cambridge, England) (2007) 36 3765-3767

a=8.721(4)Å b=10.414(4)Å c=13.992(5)Å

α=90.0000° β=90.0000° γ=90.0000°

PCBM

C₇₃H₁₄O_1.5S

Jung Hee Choi Tatsuhiko Honda Shu Seki Shunichi Fukuzumi

Chem.Commun. (2011) 47, 11213

a=10.274(2)Å b=19.101(4)Å c=19.342(4)Å

α=90.0000(9)° β=91.6161(9)° γ=90.0000(9)°

C_71.25H₁₂O₂S_3.50

Jung Hee Choi Tatsuhiko Honda Shu Seki Shunichi Fukuzumi

Chem.Commun. (2011) 47, 11213

a=9.9822(5)Å b=16.1523(11)Å c=25.744(2)Å

α=104.099(3)° β=99.991(3)° γ=90.458(3)°

C₄₃H₃₄N₄

Nakano, Hideyuki Seki, Shu Kageyama, Hiroshi

Physical chemistry chemical physics : PCCP (2010) 12, 28 7772-7774

a=16.5817(3)Å b=11.9938(2)Å c=17.3483(3)Å

α=90° β=100.1372(7)° γ=90°

C₄₂H₃₄N₄O₂

Nakano, Hideyuki Seki, Shu Kageyama, Hiroshi

Physical chemistry chemical physics : PCCP (2010) 12, 28 7772-7774

a=16.5256(3)Å b=12.1737(2)Å c=17.4298(3)Å

α=90° β=100.7497(7)° γ=90°

C_50.75H_48.5Cl_0.75N

Hiroki Yokoi Yuya Hiraoka Satoru Hiroto Daisuke Sakamaki Shu Seki Hiroshi Shinokubo

Nature Communications (2015) 6, 8215

a=13.170(5)Å b=34.623(14)Å c=36.534(14)Å

α=90° β=90° γ=90°

C₃₀H₂₀

Okamoto, Toshihiro Nakahara, Katsumasa Saeki, Akinori Seki, Shu Oh, Joon Hak Akkerman, Hylke B.Bao, Zhenan Matsuo, Yutaka

Chemistry of Materials (2011) 23, 7 1646

a=9.2589(7)Å b=10.9073(8)Å c=10.9164(9)Å

α=66.773(4)° β=80.036(4)° γ=89.745(5)°

C₃₀H₁₅F₅

Okamoto, Toshihiro Nakahara, Katsumasa Saeki, Akinori Seki, Shu Oh, Joon Hak Akkerman, Hylke B.Bao, Zhenan Matsuo, Yutaka

Chemistry of Materials (2011) 23, 7 1646

a=7.03676(13)Å b=11.5431(2)Å c=13.8379(10)Å

α=76.874(5)° β=75.870(5)° γ=74.923(5)°

C₂₀H₂₀K₂N₂O₁₂

Abe, Haruka Kawasaki, Ayumi Takeda, Takashi Hoshino, Norihisa Matsuda, Wakana Seki, Shu Akutagawa, Tomoyuki

ACS Applied Materials & Interfaces (2020)

a=16.2707Å b=8.4478Å c=8.1981Å

α=90.0000° β=91.2120° γ=90.0000°

C₃₀H₁₆O₄

Hisaki, Ichiro Kometani, Eriko Shigemitsu, Hajime Saeki, Akinori Seki, Shu Tohnai, Norimitsu Miyata, Mikiji

Crystal Growth & Design (2011) 11, 12 5488-5497

a=9.88125(18)Å b=10.12115(18)Å c=22.1855(4)Å

α=95.3050(9)° β=93.7500(9)° γ=91.7710(10)°

C₂₀H₂₀K₂N₂O₁₂

Abe, Haruka Kawasaki, Ayumi Takeda, Takashi Hoshino, Norihisa Matsuda, Wakana Seki, Shu Akutagawa, Tomoyuki

Journal of the American Chemical Society (2020)

a=16.2707Å b=8.4478Å c=8.1981Å

α=90.0000° β=91.2120° γ=90.0000°

C₂₀H₁₆Cs₂N₂O₁₀

Abe, Haruka Kawasaki, Ayumi Takeda, Takashi Hoshino, Norihisa Matsuda, Wakana Seki, Shu Akutagawa, Tomoyuki

Journal of the American Chemical Society (2020)

a=5.1996(11)Å b=6.5535(14)Å c=16.494(4)Å

α=92.691(7)° β=95.914(7)° γ=98.420(7)°

C₂₀H₁₂N₂O_9.33Rb₂

Abe, Haruka Kawasaki, Ayumi Takeda, Takashi Hoshino, Norihisa Matsuda, Wakana Seki, Shu Akutagawa, Tomoyuki

Journal of the American Chemical Society (2020)

a=7.5163(4)Å b=12.5560(7)Å c=16.8507(9)Å

α=83.769(6)° β=81.148(6)° γ=80.127(6)°

C₂₀H₂₄N₂O₁₄Rb₂

Abe, Haruka Kawasaki, Ayumi Takeda, Takashi Hoshino, Norihisa Matsuda, Wakana Seki, Shu Akutagawa, Tomoyuki

Journal of the American Chemical Society (2020)

a=5.8795(3)Å b=6.8242(4)Å c=17.4352(9)Å

α=81.502(6)° β=88.355(6)° γ=63.886(5)°

C₈₇H₅₆Cl₂N₄O₄

Inoue, Yuki Sakamaki, Daisuke Tsutsui, Yusuke Gon, Masayuki Chujo, Yoshiki Seki, Shu

Journal of the American Chemical Society (2018) 140, 23 7152-7158

a=11.5847(4)Å b=15.8101(5)Å c=19.4838(6)Å

α=68.7490(13)° β=75.1040(15)° γ=78.4300(14)°

C₁₀₄H₁₀₆Cl₁₂N₈O₃Sb₂

Inoue, Yuki Sakamaki, Daisuke Tsutsui, Yusuke Gon, Masayuki Chujo, Yoshiki Seki, Shu

Journal of the American Chemical Society (2018) 140, 23 7152-7158

a=19.4101Å b=24.8072Å c=10.7401Å

α=90.0000° β=90.0000° γ=90.0000°

C₂₆H₂₆N₂

Inoue, Yuki Sakamaki, Daisuke Tsutsui, Yusuke Gon, Masayuki Chujo, Yoshiki Seki, Shu

Journal of the American Chemical Society (2018) 140, 23 7152-7158

a=24.051(10)Å b=5.6437(19)Å c=16.910(7)Å

α=90.0000° β=122.885(5)° γ=90.0000°

C₉₈H₈₈N₈

Inoue, Yuki Sakamaki, Daisuke Tsutsui, Yusuke Gon, Masayuki Chujo, Yoshiki Seki, Shu

Journal of the American Chemical Society (2018) 140, 23 7152-7158

a=33.435(7)Å b=18.320(4)Å c=24.428(5)Å

α=90.0000° β=90.0000° γ=90.0000°

C₉₄H₈₀Cl₄N₈

Inoue, Yuki Sakamaki, Daisuke Tsutsui, Yusuke Gon, Masayuki Chujo, Yoshiki Seki, Shu

Journal of the American Chemical Society (2018) 140, 23 7152-7158

a=31.014(9)Å b=15.951(4)Å c=15.969(4)Å

α=90.0000° β=103.327(5)° γ=90.0000°

C₂₄H₂₀O₄

Leung, Franco King-Chi Ishiwari, Fumitaka Kajitani, Takashi Shoji, Yoshiaki Hikima, Takaaki Takata, Masaki Saeki, Akinori Seki, Shu Yamada, Yoichi M. A.Fukushima, Takanori

Journal of the American Chemical Society (2016) 138, 36 11727-11733

a=13.5285(18)Å b=8.4191(12)Å c=15.857(2)Å

α=90° β=90° γ=90°

C₁₂₀H₁₂₄Cl₄₄N₈O₈Sb₆

Sakamaki, Daisuke Ito, Akihiro Tsutsui, Yusuke Seki, Shu

The Journal of organic chemistry (2017) 82, 24 13348-13358

a=25.919(12)Å b=25.919(12)Å c=11.739(6)Å

α=90.0000° β=90.0000° γ=90.0000°

C₅₃H₄₆Cl₂N₄O₄

Sakamaki, Daisuke Ito, Akihiro Tsutsui, Yusuke Seki, Shu

The Journal of organic chemistry (2017) 82, 24 13348-13358

a=12.216(2)Å b=15.614(3)Å c=23.054(4)Å

α=90.0000° β=92.341(3)° γ=90.0000°