Add xyz files to be used in future tests (#164)

tools/generate-unit-test-expect/IRC/Endo/Endo-07.xyz

+19
+ comment:c
+C -0.7942770 1.0127960 -0.6712530
+C -0.7941460 1.0126960 0.6711290
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+H 1.4474690 0.9129160 2.5427439
+H 1.4481180 0.9157090 -2.5420611
+C -0.9685560 -0.3890460 -1.1290140
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+O -0.9747280 -1.1934650 -0.0001840
+H -0.8736620 1.8442280 -1.3579140
+H -0.8732870 1.8440330 1.3579310

tools/generate-unit-test-expect/IRC/Endo/Endo-08.xyz

+19
+ comment:c
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+C 1.9886121 -0.0399650 0.7248800
+C 1.9887940 -0.0391550 -0.7251050
+C 1.5863510 1.0039390 -1.4725150
+H 1.4670420 1.9980010 1.0572900
+H 2.1808071 -0.9919390 1.2157670
+H 2.1814120 -0.9905210 -1.2170039
+H 1.4666539 1.9990211 -1.0553610
+H 1.4732120 0.9127780 2.5498810
+H 1.4738320 0.9155540 -2.5492051
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+O -0.9737860 -1.1943290 -0.0001850
+H -0.8794890 1.8451459 -1.3592690
+H -0.8790870 1.8449399 1.3593130

tools/generate-unit-test-expect/IRC/Endo/Endo-09.xyz

+19
+ comment:c
+C -0.8353500 1.0165120 -0.6688360
+C -0.8351760 1.0164000 0.6687650
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+C 1.9900790 -0.0406840 0.7264900
+C 1.9902591 -0.0398830 -0.7267270
+C 1.6045190 1.0042460 -1.4787350
+H 1.4740050 1.9972110 1.0637150
+H 2.1814420 -0.9940610 1.2151181
+H 2.1820509 -0.9926590 -1.2163570
+H 1.4736021 1.9982181 -1.0617959
+H 1.4999959 0.9122960 2.5568810
+H 1.5005920 0.9150620 -2.5562119
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+O -0.9729310 -1.1949840 -0.0001850
+H -0.8880900 1.8461330 -1.3603290
+H -0.8876600 1.8459160 1.3604020

tools/generate-unit-test-expect/IRC/Endo/Endo-10.xyz

+19
+ comment:c
+C -0.8557580 1.0182869 -0.6680060
+C -0.8555630 1.0181700 0.6679610
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+C 1.9918730 -0.0413840 0.7278670
+C 1.9920540 -0.0405910 -0.7281170
+C 1.6224850 1.0044830 -1.4847500
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+H 2.1825149 -0.9961170 1.2142740
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+H -0.8991570 1.8471780 -1.3611341
+H -0.8986960 1.8469490 1.3612390

tools/generate-unit-test-expect/IRC/Endo/Endo-11.xyz

+19
+ comment:c
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+C 1.9941820 -0.0412870 -0.7293200
+C 1.6403069 1.0046580 -1.4904630
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+H 2.1838529 -0.9981640 1.2132500
+H 2.1844850 -0.9967850 -1.2144990
+H 1.4926161 1.9978060 -1.0759190
+H 1.5549860 0.9103430 2.5700600
+H 1.5555450 0.9130880 -2.5694070
+C -0.9872860 -0.3898940 -1.1276070
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+H -0.9123540 1.8482701 -1.3617220
+H -0.9118610 1.8480279 1.3618580

tools/generate-unit-test-expect/IRC/Endo/Endo-12.xyz

+19
+ comment:c
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+H -0.9275020 1.8493969 -1.3621340
+H -0.9269760 1.8491430 1.3623050

tools/generate-unit-test-expect/IRC/Endo/Endo-13.xyz

+19
+ comment:c
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+C 1.9995940 -0.0428470 -0.7312700
+C 1.6755691 1.0049520 -1.5004840
+H 1.5186800 1.9974860 1.0909671
+H 2.1866770 -1.0024290 1.2110690
+H 2.1873479 -1.0010650 -1.2123280
+H 1.5181479 1.9984660 -1.0891430
+H 1.6092770 0.9084030 2.5811779
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+H -0.9443720 1.8505340 -1.3624250
+H -0.9438110 1.8502671 1.3626310

tools/generate-unit-test-expect/IRC/Endo/Endo-14.xyz

+19
+ comment:c
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+H -0.9621950 1.8513460 1.3628340

tools/generate-unit-test-expect/IRC/Endo/Endo-15.xyz

+19
+ comment:c
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+H 1.6614920 0.9090270 -2.5893970
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+O -0.9721370 -1.1945421 -0.0001870
+H -0.9828170 1.8526430 -1.3626670
+H -0.9821790 1.8523510 1.3629470

tools/generate-unit-test-expect/IRC/Endo/Endo-16.xyz

+19
+ comment:c
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+H 1.6861540 0.9082950 -2.5929179
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+H -1.0041870 1.8535800 -1.3626699
+H -1.0035191 1.8532749 1.3629870

tools/generate-unit-test-expect/IRC/Endo/Endo-17.xyz

+19
+ comment:c
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+C -0.9982990 1.0272950 0.6655110
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tools/generate-unit-test-expect/IRC/Endo/Endo-18.xyz

+19
+ comment:c
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tools/generate-unit-test-expect/IRC/Endo/Endo-19.xyz

+19
+ comment:c
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+C 1.7781640 1.0042000 1.5196379
+C 2.0268390 -0.0493450 0.7344190
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+H 2.1965630 -1.0157681 1.2062730
+H 2.1973319 -1.0144579 -1.2075760
+H 1.6176860 2.0035169 -1.1165140
+H 1.7531450 0.9041580 2.6007929
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tools/generate-unit-test-expect/IRC/Endo/Endo-20.xyz

+19
+ comment:c
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tools/generate-unit-test-expect/IRC/Endo/Endo-21.xyz

+19
+ comment:c
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tools/generate-unit-test-expect/IRC/Endo/Endo-22.xyz

+19
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tools/generate-unit-test-expect/IRC/Endo/Endo-23.xyz

+19
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tools/generate-unit-test-expect/IRC/Endo/Endo-24.xyz

+19
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tools/generate-unit-test-expect/IRC/Endo/Endo-25.xyz

+19
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tools/generate-unit-test-expect/IRC/Endo/Endo-26.xyz

+19
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