0 mol 7 unq 0 iso 0 dist 8.05125 7.15434 9.17482 7.29541 12.166 5.72491 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 5.41248 4.92734 7.36147 9.91124 14.3294 7.3915 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 8.0346 9.00543 9.81889 12.5123 17.9 9.63263 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 7.62469 9.17086 5.39546 8.33667 11.9259 9.93832 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 4.80247 9.77018 10.6193 7.79856 7.03635 8.63486 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.88969 7.98444 5.03467 6.75062 12.6209 9.44501 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.7939 8.16299 7.80518 11.9686 15.5713 8.85586 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 6.7939 8.16299 7.80518 11.4934 12.125 7.11 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 6.85356 8.16299 11.6012 11.9686 18.1511 8.85586 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 6.85356 8.16299 11.6012 11.4934 15.503 7.11 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 8.44695 8.27015 7.80518 16.4476 15.5713 8.85586 numMergedOcc 0
11 mol 73 unq 5 iso 0 dist 8.44695 8.27015 7.80518 14.727 12.125 7.11 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 9.225 5.56964 9.95835 8.88275 14.3653 4.79949 numMergedOcc 0
13 mol 76 unq 1 iso 0 dist 9.225 5.56964 9.95835 7.18485 14.621 7.27693 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 7.88143 7.00285 13.0429 10.8678 15.3406 5.88354 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 6.62952 7.00285 11.5098 10.8678 16.4455 5.88354 numMergedOcc 0
16 mol 98 unq 2 iso 0 dist 4.3521 8.02354 11.5098 13.5865 16.4455 5.88354 numMergedOcc 0
17 mol 98 unq 3 iso 0 dist 5.26536 8.05602 12.5137 14.9908 19.2041 7.26086 numMergedOcc 0
18 mol 98 unq 4 iso 0 dist 7.14505 9.00692 6.07909 9.70366 10.8208 8.8368 numMergedOcc 0
19 mol 98 unq 5 iso 0 dist 4.7588 6.26542 6.07909 7.63357 10.8208 8.8368 numMergedOcc 0
20 mol 124 unq 0 iso 0 dist 8.03603 6.35314 5.1738 4.85358 11.7497 8.58188 numMergedOcc 0
21 mol 131 unq 0 iso 0 dist 9.14809 9.33945 14.651 11.8905 16.7982 8.86329 numMergedOcc 0
22 mol 131 unq 1 iso 0 dist 6.45169 9.33945 7.47571 11.8905 14.4427 8.86329 numMergedOcc 0
23 mol 140 unq 0 iso 0 dist 6.55217 7.83582 9.7827 11.3235 13.7702 5.39064 numMergedOcc 0
24 mol 140 unq 1 iso 0 dist 7.21686 7.83582 5.80354 11.3235 10.6238 5.39064 numMergedOcc 0
25 mol 171 unq 0 iso 0 dist 8.42643 7.13441 5.60928 6.15895 9.77285 5.10618 numMergedOcc 0
26 mol 218 unq 0 iso 0 dist 9.11823 4.851 5.97687 11.3699 13.5097 9.20961 numMergedOcc 0
27 mol 222 unq 0 iso 0 dist 7.99609 8.7419 4.81992 7.26742 5.98014 7.862 numMergedOcc 0
28 mol 230 unq 0 iso 0 dist 9.32781 5.62804 9.33469 10.1088 9.88392 6.41286 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 5.77828 5.67917 5.65008 6.85179 10.9992 6.66971 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 5.77828 8.96639 10.5857 6.85179 10.9992 6.4398 numMergedOcc 0
31 mol 238 unq 2 iso 0 dist 9.01742 9.38753 5.81768 8.09178 9.6438 5.52379 numMergedOcc 0
32 mol 258 unq 0 iso 0 dist 8.73425 8.21585 5.90131 12.2193 12.869 7.99477 numMergedOcc 0
33 mol 258 unq 1 iso 0 dist 8.73425 8.21585 5.90131 8.45446 12.8643 7.86627 numMergedOcc 0
34 mol 258 unq 2 iso 0 dist 9.65711 8.21585 4.51422 12.2193 12.3875 7.99477 numMergedOcc 0
35 mol 258 unq 3 iso 0 dist 9.65711 8.21585 4.51422 8.45446 10.8981 7.86627 numMergedOcc 0
36 mol 276 unq 0 iso 0 dist 7.01597 8.54938 5.49958 5.38576 4.92907 7.88706 numMergedOcc 0
