0 mol 7 unq 0 iso 0 dist 6.0323 8.05125 5.96526 7.15434 5.70161 9.17482 7.29541 10.0158 12.166 5.72491 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.53564 7.62469 6.44784 9.17086 10.323 5.39546 8.33667 15.1191 11.9259 9.93832 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.02351 6.7939 5.4653 8.16299 11.2674 7.80518 11.9686 17.0516 15.5713 8.85586 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 7.02351 6.7939 5.4653 8.16299 11.2674 7.80518 11.4934 12.9368 12.125 7.11 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 7.02351 6.85356 4.63063 8.16299 11.2674 11.6012 11.9686 17.0516 18.1511 8.85586 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 7.02351 6.85356 4.63063 8.16299 11.2674 11.6012 11.4934 12.9368 15.503 7.11 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 8.87856 7.88143 6.62867 7.00285 9.94628 13.0429 10.8678 10.8121 15.3406 5.88354 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 8.87856 6.62952 11.2334 7.00285 9.94628 11.5098 10.8678 10.8121 16.4455 5.88354 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 6.2491 7.88143 12.7928 7.00285 5.39087 13.0429 10.8678 11.2452 15.3406 5.88354 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 6.2491 6.62952 7.89992 7.00285 5.39087 11.5098 10.8678 11.2452 16.4455 5.88354 numMergedOcc 0
10 mol 98 unq 4 iso 0 dist 3.59451 4.3521 7.89992 8.02354 5.39087 11.5098 13.5865 11.2452 16.4455 5.88354 numMergedOcc 0
11 mol 98 unq 5 iso 0 dist 8.26758 4.7588 5.33623 6.26542 10.844 6.07909 7.63357 12.9581 10.8208 8.8368 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 5.61764 8.03603 5.26643 6.35314 5.31501 5.1738 4.85358 10.0179 11.7497 8.58188 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 7.8034 9.14809 9.45822 9.33945 8.25445 14.651 11.8905 7.5344 16.7982 8.86329 numMergedOcc 0
14 mol 131 unq 1 iso 0 dist 7.8034 6.45169 10.1774 9.33945 8.25445 7.47571 11.8905 7.5344 14.4427 8.86329 numMergedOcc 0
15 mol 140 unq 0 iso 0 dist 9.74209 6.55217 4.8476 7.83582 12.1389 9.7827 11.3235 14.6388 13.7702 5.39064 numMergedOcc 0
16 mol 140 unq 1 iso 0 dist 9.74209 7.21686 8.53976 7.83582 12.1389 5.80354 11.3235 14.6388 10.6238 5.39064 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 5.98076 9.11823 10.7072 4.851 8.31343 5.97687 11.3699 11.6289 13.5097 9.20961 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 7.10689 7.99609 9.50337 8.7419 8.81265 4.81992 7.26742 12.5498 5.98014 7.862 numMergedOcc 0
19 mol 230 unq 0 iso 0 dist 5.00735 9.32781 4.85368 5.62804 7.07028 9.33469 10.1088 10.3524 9.88392 6.41286 numMergedOcc 0
20 mol 230 unq 1 iso 0 dist 6.73755 9.32781 7.91665 5.62804 5.26217 9.33469 10.1088 10.4504 9.88392 6.41286 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 6.59521 8.73425 5.27718 8.21585 9.22664 5.90131 12.2193 14.7484 12.869 7.99477 numMergedOcc 0
22 mol 258 unq 1 iso 0 dist 6.59521 8.73425 5.27718 8.21585 9.22664 5.90131 8.45446 13.7217 12.8643 7.86627 numMergedOcc 0
23 mol 258 unq 2 iso 0 dist 6.59521 9.65711 9.46467 8.21585 9.22664 4.51422 12.2193 14.7484 12.3875 7.99477 numMergedOcc 0
24 mol 258 unq 3 iso 0 dist 6.59521 9.65711 9.46467 8.21585 9.22664 4.51422 8.45446 13.7217 10.8981 7.86627 numMergedOcc 0
