0 mol 122 unq 0 iso 0 dist 8.33083 8.40483 5.41882 12.2162 6.00603 11.2481 numMergedOcc 0
1 mol 127 unq 0 iso 0 dist 8.40046 8.03243 14.085 12.1959 6.08673 17.7403 numMergedOcc 0
2 mol 178 unq 0 iso 0 dist 8.0974 5.20764 5.25267 9.80877 9.11204 11.7594 numMergedOcc 0
3 mol 182 unq 0 iso 0 dist 7.86625 9.23118 11.1088 4.82437 9.56028 13.9393 numMergedOcc 0
4 mol 206 unq 0 iso 0 dist 6.97859 8.42763 5.94313 5.84459 9.21377 13.1287 numMergedOcc 0
5 mol 214 unq 0 iso 0 dist 8.49704 6.35728 6.67959 4.112 7.46481 8.70987 numMergedOcc 0
6 mol 222 unq 0 iso 0 dist 8.7347 5.04916 7.61682 15.1289 6.74196 14.2305 numMergedOcc 0
7 mol 222 unq 1 iso 0 dist 8.7347 5.04916 7.61682 13.6078 8.36842 14.562 numMergedOcc 0
8 mol 222 unq 2 iso 0 dist 8.7347 5.04916 7.61682 13.6261 9.75472 15.6152 numMergedOcc 0
9 mol 224 unq 0 iso 0 dist 9.79616 8.60781 7.12232 12.65 8.79428 10.8888 numMergedOcc 0
10 mol 274 unq 0 iso 0 dist 6.00877 5.42845 5.31116 15.2854 9.30212 12.703 numMergedOcc 0
11 mol 274 unq 1 iso 0 dist 6.00877 5.42845 5.31116 5.9397 6.4611 6.66172 numMergedOcc 0
12 mol 274 unq 2 iso 0 dist 8.66451 5.62484 5.31116 16.784 9.30212 12.703 numMergedOcc 0
13 mol 274 unq 3 iso 0 dist 8.66451 5.62484 5.31116 4.89003 6.4611 6.66172 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 9.02914 6.73204 10.7534 13.3706 5.46926 15.7984 numMergedOcc 0
15 mol 277 unq 1 iso 0 dist 9.02914 6.73204 10.7534 12.1739 5.13913 15.544 numMergedOcc 0
16 mol 277 unq 2 iso 0 dist 6.90434 6.73204 12.6113 8.51268 9.35539 14.217 numMergedOcc 0
17 mol 277 unq 3 iso 0 dist 6.90434 6.73204 12.6113 13.3706 8.9682 15.7984 numMergedOcc 0
18 mol 277 unq 4 iso 0 dist 6.90434 6.73204 12.6113 12.1739 6.92711 15.544 numMergedOcc 0
19 mol 284 unq 0 iso 0 dist 8.42412 9.1161 5.21666 6.34668 6.41303 9.69262 numMergedOcc 0
