From a70284451d276e4de067d9045691933981fe6490 Mon Sep 17 00:00:00 2001 From: Aliakasndr Dziarkach <18146690+AliaksandrDziarkach@users.noreply.github.com> Date: Sun, 17 Nov 2024 17:24:31 +0300 Subject: [PATCH] Fix UT --- .../tests/layout/ref/macrocycles.sdf | 30 +++++++++---------- 1 file changed, 15 insertions(+), 15 deletions(-) diff --git a/api/tests/integration/tests/layout/ref/macrocycles.sdf b/api/tests/integration/tests/layout/ref/macrocycles.sdf index 67effa21ef..7fec685ef2 100644 --- a/api/tests/integration/tests/layout/ref/macrocycles.sdf +++ b/api/tests/integration/tests/layout/ref/macrocycles.sdf @@ -558,14 +558,14 @@ $$$$ 0.0000 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 0.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 - 4.0000 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 5.0000 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + 4.0000 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + 5.0000 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 3.4641 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 7.0000 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 8.0000 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + 7.0000 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + 8.0000 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0000 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 @@ -691,7 +691,7 @@ $$$$ -1.5655 2.8386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1742 3.0211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4991 2.4803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 - -0.7762 3.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -0.7762 3.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1437 2.5244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 4.0447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4227 4.9945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 @@ -2231,7 +2231,7 @@ $$$$ 27.7052 4.3571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.2766 5.7584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.3359 8.4774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 31.3347 8.4286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + 31.3348 8.4286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.8764 9.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.4193 10.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.4205 10.2074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 @@ -3048,7 +3048,7 @@ $$$$ 4.5902 4.9282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9705 2.0682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3547 2.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 9.3317 3.7802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + 9.3317 3.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1860 4.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0633 3.8202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4797 4.7732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 @@ -5203,15 +5203,15 @@ $$$$ -INDIGO-01000000002D 110116 0 0 1 0 0 0 0 0999 V2000 - -5.1103 0.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - -5.4732 1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4616 1.5515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -5.4732 1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -5.1103 0.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8476 2.1800 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8592 2.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1076 2.6880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3032 3.6687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5516 4.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - -1.6045 4.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -1.6045 4.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 4.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0941 4.3460 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3293 3.4715 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 @@ -5248,8 +5248,8 @@ $$$$ 1.0484 5.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 4.5622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6595 6.3419 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 - 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