@@ -153,7 +153,7 @@ function findPairBonds(unitA: Unit.Atomic, unitB: Unit.Atomic, props: BondComput
? thresholdAB
: beI < 0
? thresholdA
- : (thresholdA + getElementThreshold(beI)) / 2; // not sure if avg or min but max is too big
+ : (thresholdA + getElementThreshold(beI)) / 1.95; // not sure if avg or min but max is too big
if (dist <= pairingThreshold) {
const atomIdB = label_atom_idB.value(bI);
@@ -211,7 +211,7 @@ function findBonds(unit: Unit.Atomic, props: BondComputationProps): IntraUnitBon
atomA[atomA.length] = _aI;