Unresolvabe inconsistency between charge and multiplicity and orbital occupancies. Orbital data will be ignored. This is an error getting while opening a molecule using gauss view after the optimization is done.
%nprocshared=24
%mem=56GB
%chk=orthonitrosylphenol-frag-guess.chk
# opt ub3lyp/6-31g(d) guess=(only,fragment=2) geom=connectivity
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1 2 0 2 1 1
C(Fragment=1) -2.34043623 -0.90257510 0.00004941
C(Fragment=1) -2.40274275 0.50557462 -0.00037577
C(Fragment=1) -1.22829111 1.22568322 -0.00035579
C(Fragment=1) 0.03018458 0.58137137 0.00006969
C(Fragment=1) 0.09123245 -0.83706938 0.00027462
C(Fragment=1) -1.12330031 -1.55774903 0.00034168
H(Fragment=1) -3.25755883 -1.48566408 0.00008781
H(Fragment=1) -3.36321934 1.01190620 -0.00077400
H(Fragment=1) -1.21607933 2.31039898 -0.00055680
H(Fragment=1) -1.06253923 -2.64108206 0.00058095
O(Fragment=1) 1.17993898 -1.62887313 0.00027823
C(Fragment=1) 2.52609105 -1.14347629 -0.00063507
H(Fragment=1) 3.14153528 -2.04558095 -0.00110003
H(Fragment=1) 2.72962450 -0.53915885 -0.88789417
H(Fragment=1) 2.73099047 -0.53923662 0.88638042
N(Fragment=2) 1.24192945 1.33050578 0.00046614
O(Fragment=2) 1.10597529 2.55191320 0.00019679
1 2 1.5 6 1.5 7 1.0
2 3 1.5 8 1.0
3 4 1.5 9 1.0
4 5 1.5 16 1.0
5 6 1.5 11 1.0
6 10 1.0
7
8
9
10
11 12 1.0
12 13 1.0 14 1.0 15 1.0
13
14
15
16 17 2.0
17
Please help me with a detailed description.
Thank you in advance. ..
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