0 mol 15 unq 0 iso 0 dist 5.94245 5.72359 5.33641 4.21233 6.31608 5.7147 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.12171 6.77987 9.39212 6.50899 14.2253 8.31631 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 7.77386 9.6401 6.23298 6.63195 11.219 8.78414 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 7.98453 6.89527 5.26394 7.68524 10.0501 5.88409 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.04111 9.77648 11.1059 17.1322 19.9773 9.08745 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 6.9297 8.52697 3.99035 8.47393 6.86517 9.04293 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 5.99046 6.24296 11.0952 3.81285 9.07499 4.29937 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 5.99046 6.24296 11.0952 6.17121 10.671 5.37869 numMergedOcc 0
8 mol 85 unq 2 iso 0 dist 5.99046 6.83218 12.5181 3.81285 9.07499 3.65628 numMergedOcc 0
9 mol 85 unq 3 iso 0 dist 5.99046 6.83218 12.5181 6.17121 10.671 4.05415 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 4.86532 6.64714 10.6223 9.46631 13.4457 7.71625 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 6.70158 9.43355 14.433 13.6305 17.856 6.67678 numMergedOcc 0
12 mol 93 unq 1 iso 0 dist 6.70158 9.43355 14.433 14.1431 19.1296 7.24956 numMergedOcc 0
13 mol 93 unq 2 iso 0 dist 6.70158 9.43355 14.433 3.99275 7.48947 8.28591 numMergedOcc 0
14 mol 93 unq 3 iso 0 dist 6.70158 9.43355 14.433 6.46195 11.4564 9.40687 numMergedOcc 0
15 mol 93 unq 4 iso 0 dist 6.70158 5.64141 9.54244 3.99275 7.48947 5.35008 numMergedOcc 0
16 mol 93 unq 5 iso 0 dist 6.70158 5.64141 9.54244 6.46195 11.4564 8.84576 numMergedOcc 0
17 mol 93 unq 6 iso 0 dist 6.70158 5.46186 9.86691 3.99275 7.48947 8.30921 numMergedOcc 0
18 mol 93 unq 7 iso 0 dist 6.70158 5.46186 9.86691 6.46195 11.4564 7.39732 numMergedOcc 0
19 mol 93 unq 8 iso 0 dist 6.70158 5.46186 9.86691 10.4525 13.4607 9.67744 numMergedOcc 0
20 mol 93 unq 9 iso 0 dist 7.29701 9.43355 14.9656 13.6305 20.1017 6.67678 numMergedOcc 0
21 mol 93 unq 10 iso 0 dist 7.29701 9.43355 14.9656 14.1431 20.0375 7.24956 numMergedOcc 0
22 mol 93 unq 11 iso 0 dist 7.29701 9.43355 14.9656 3.99275 11.2438 8.28591 numMergedOcc 0
23 mol 93 unq 12 iso 0 dist 7.29701 9.43355 14.9656 6.46195 12.0199 9.40687 numMergedOcc 0
24 mol 93 unq 13 iso 0 dist 7.29701 5.64141 11.5397 3.99275 11.2438 5.35008 numMergedOcc 0
25 mol 93 unq 14 iso 0 dist 7.29701 5.64141 11.5397 6.46195 12.0199 8.84576 numMergedOcc 0
26 mol 93 unq 15 iso 0 dist 7.29701 5.46186 5.43515 3.99275 11.2438 8.30921 numMergedOcc 0
27 mol 93 unq 16 iso 0 dist 7.29701 5.46186 5.43515 6.46195 12.0199 7.39732 numMergedOcc 0
28 mol 93 unq 17 iso 0 dist 7.29701 5.46186 5.43515 10.4525 14.9939 9.67744 numMergedOcc 0
29 mol 123 unq 0 iso 0 dist 7.36361 6.49766 10.9073 3.61945 7.30244 4.14492 numMergedOcc 0
30 mol 186 unq 0 iso 0 dist 7.77211 9.22792 8.65911 10.2655 12.4962 6.94594 numMergedOcc 0
31 mol 186 unq 1 iso 0 dist 7.77211 9.22792 8.65911 11.6331 11.8931 5.81881 numMergedOcc 0
32 mol 186 unq 2 iso 0 dist 7.77211 5.00402 3.87082 8.73397 8.2241 9.4366 numMergedOcc 0
33 mol 264 unq 0 iso 0 dist 8.68638 6.66615 13.0036 3.9472 11.5459 8.55386 numMergedOcc 0
34 mol 279 unq 0 iso 0 dist 6.35591 8.88095 3.80663 6.15282 8.77098 8.62266 numMergedOcc 0
35 mol 287 unq 0 iso 0 dist 8.58448 9.98518 11.1883 3.76412 11.062 8.06767 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 8.58448 9.98518 11.1883 3.76412 11.062 8.06767 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 8.58448 9.98518 11.1883 3.76412 11.062 8.06767 numMergedOcc 0
