TRIPLET UHF PM7 Methylene, triplet H=99.8 HR=DUMMY H 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 C 1.01421488 +1 0.0000000 +0 0.0000000 +0 1 0 0 H 1.01421593 +1 178.1696559 +1 0.0000000 +0 2 1 0